Chemical compounds for High-Throughput screening and
Building Blocks for Combinatorial chemistry

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STK551690
Synonyms: methyl4- [5- (4- nitrophenyl)- 4,6- dioxo- 2- phenylhexahydro- 2H- pyrrolo[3,4- d][1,2]oxazol- 3- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK551691
Synonyms: 4- (4- tert- butylphenoxy)- 2- (2- fluorophenyl)quinazoline
Smiles: Fc1ccccc1c1nc(Oc2ccc(cc2)C(C)(C)C)c2c(n1)cccc2

STK551693
Synonyms: ethyl3- ({3- [4- (5- chloro- 2- methylphenyl)piperazin- 1- yl]propanoyl}amino)- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1cc(Cl)ccc1C)cc(c(c2)OC)OC

STK551695
Synonyms: 2- {[4- amino- 6- (propan- 2- yl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- (4- chlorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nc(N)c2c(n1)sc1c2CC(OC1)C(C)C

STK551698
Synonyms: 5,5- dimethyl- 2- (3- nitrophenyl)- 4- phenyl- 2,5- dihydro- 1H- imidazol- 1- ol3- oxide
Smiles: [O-][N+]1=C(c2ccccc2)C(N(C1c1cccc(c1)[N+](=O)[O-])O)(C)C

STK551699
Synonyms: ethyl7- ({[4- (2- methoxyphenyl)piperazin- 1- yl]acetyl}amino)- 5H- [1,3]dioxolo[4,5- f]indole- 6- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1OC)cc1c(c2)OCO1

STK551701
Synonyms: (2E)- N- [(2- methoxydibenzo[b,d]furan- 3- yl)carbamothioyl]- 3- (thiophen- 2- yl)prop- 2- enamide
Smiles: COc1cc2c(cc1NC(=S)NC(=O)/C=C/c1cccs1)oc1c2cccc1

STK551702
Synonyms: (8S,8aR,11aS,11bS)- 8- (2,2- dimethylpropanoyl)- 10- (4- fluorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2c2ccccc2C=C1)C(=O)C(C)(C)C

STK551703
Synonyms: 2- (3,4- dimethoxyphenyl)- 7- ethoxy- 6- methoxy- 4- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}quinazoline
Smiles: CCOc1cc2nc(nc(c2cc1OC)N1CCN(CC1)c1cccc(c1)C(F)(F)F)c1ccc(c(c1)OC)OC

STK551704
Synonyms: 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl)sulfanyl]- N- (naphthalen- 1- yl)acetamide
Smiles: CCn1c(SCC(=O)Nc2cccc3c2cccc3)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551706
Synonyms: 3- {[(E)- (3,4- dimethoxyphenyl)methylidene]amino}- 8- methoxy- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1nc(C)n(c(=O)c1[nH]2)/N=C/c1ccc(c(c1)OC)OC

STK551707
Synonyms: di- tert- butyl2,2- dibromocyclopropane- 1,1- dicarboxylate
Smiles: O=C(C1(CC1(Br)Br)C(=O)OC(C)(C)C)OC(C)(C)C

STK551708
Synonyms: 3,3'- {[5- (ethylsulfanyl)- 1,3,4- thiadiazol- 2- yl]imino}dipropanenitrile
Smiles: CCSc1nnc(s1)N(CCC#N)CCC#N

STK551710
Synonyms: 2- [(4- oxo- 3- phenyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N,N- dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCCC3)CCC

STK551712
Synonyms: 1- (1- benzyl- 5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- (thiomorpholin- 4- yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCSCC1)c(n2Cc1ccccc1)C

STK551713
Synonyms: 3- (3- methylphenyl)- 2- [(2- phenylethyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: Cc1cccc(c1)n1c(SCCc2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551714
Synonyms: 3- (4- chlorophenyl)- 2- [(E)- 2- (2- methyl- 1H- indol- 3- yl)ethenyl]quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)n1c(/C=C/c2c(C)[nH]c3c2cccc3)nc2c(c1=O)cccc2

STK551716
Synonyms: (5Z)- 1- (3,4- dimethylphenyl)- 5- {3- [(1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)methyl]- 4- methoxybenzylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(c(c1)C)C

STK551717
Synonyms: 6- iodo- 3- (3- methylphenyl)- 2- {[2- (morpholin- 4- yl)- 2- oxoethyl]sulfanyl}quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)SCC(=O)N1CCOCC1)c1cccc(c1)C

STK551718
Synonyms: 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: O=C(N(c1ccccc1)c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK551719
Synonyms: 2- amino- 1- (4- fluorobenzyl)- N- (4- methylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1c2nc3ccccc3nc2n(c1N)Cc1ccc(cc1)F

STK551720
Synonyms: 4- [(2,3,5,6- tetrafluoropyridin- 4- yl)oxy]phenol
Smiles: Oc1ccc(cc1)Oc1c(F)c(F)nc(c1F)F

STK551723
Synonyms: 11- (3- chlorophenyl)- N- (2- ethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccccc1Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cccc(c1)Cl)C)c1ccccc1

STK551724
Synonyms: (6aS,6bR,9aS,10R)- 10- (2,2- dimethylpropanoyl)- 8- (4- methoxyphenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)C(C)(C)C

STK551725
Synonyms: ethyl4- {[11- (3- chlorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)Cl)c(nn1c1ccccc1)C

STK551726
Synonyms: methyl4- [10- methyl- 8- phenyl- 6- (phenylamino)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccccc1)nc1c2cccc1

STK551729
Synonyms: N- (3- chloro- 2- methylphenyl)- 2- (2- fluorophenyl)quinazolin- 4- amine
Smiles: Fc1ccccc1c1nc(Nc2cccc(c2C)Cl)c2c(n1)cccc2

STK551732
Synonyms: N- (3- chloro- 4- methylphenyl)- 11- (4- chlorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Clc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)C)c1ccccc1

STK551733
Synonyms: 2- amino- N- hexyl- 1- (4- sulfamoylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)S(=O)(=O)N

STK551734
Synonyms: ethyl3- {[3- (2,6- dimethylmorpholin- 4- yl)propanoyl]amino}- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CC(C)OC(C1)C)cc(c(c2)OC)OC

STK551735
Synonyms: tert- butyl(2''R,3''R)- 2''- (4- nitrophenyl)- 4',6'- dioxo- 2'',3''- dihydro- 10b''H- dispiro[cyclohexane- 1,2'- [1,3]dioxane- 5',1''- pyrrolo[2,1- a]phthalazine]- 3''- carboxylate
Smiles: O=C([C@@H]1N2N=Cc3c(C2C2([C@H]1c1ccc(cc1)[N+](=O)[O-])C(=O)OC1(OC2=O)CCCCC1)cccc3)OC(C)(C)C

STK551736
Synonyms: (4aS,4bR,7aS,8R)- 6- (4- methylphenyl)- 8- [(3- nitrophenyl)carbonyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=CC=N1)C(=O)c1cccc(c1)[N+](=O)[O-]

STK551738
Synonyms: 2- (2- fluorophenyl)- 4- {(2Z)- 2- [1- (4- methylphenyl)ethylidene]hydrazinyl}quinazoline
Smiles: Cc1ccc(cc1)/C(=N\Nc1nc(nc2c1cccc2)c1ccccc1F)/C

STK551739
Synonyms: 2- [5- (4- bromophenyl)- 3- (2- methoxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 6- chloro- 4- phenylquinazoline
Smiles: COc1ccccc1C1=NN(C(C1)c1ccc(cc1)Br)c1nc2ccc(cc2c(n1)c1ccccc1)Cl

STK551741
Synonyms: (5E)- 5- [(1- acetyl- 1H- indol- 3- yl)methylidene]- 1- (2- ethylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCc1ccccc1N1C(=O)NC(=O)/C(=C\c2cn(c3c2cccc3)C(=O)C)/C1=O

STK551742
Synonyms: 3- (2- chlorophenyl)- 2- {(E)- 2- [4- (dimethylamino)phenyl]ethenyl}- 6- iodoquinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(cc1)N(C)C)c1ccccc1Cl

STK551743
Synonyms: 2- {[1- (2- chlorobenzyl)- 1H- benzimidazol- 2- yl]sulfanyl}- N'- [(E)- 1H- indol- 3- ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nc2c(n1Cc1ccccc1Cl)cccc2)N/N=C/c1c[nH]c2c1cccc2

STK551744
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N'- [(E)- (3- methylthiophen- 2- yl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccccc1)N/N=C/c1sccc1C

STK551745
Synonyms: 2- (methylsulfanyl)- N- (2- phenylethyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- amine
Smiles: CSc1nc(NCCc2ccccc2)c2c(n1)sc1c2CCCC1

STK551746
Synonyms: ethyl3- {[3- (4- benzylpiperazin- 1- yl)propanoyl]amino}- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)Cc1ccccc1)cc(c(c2)OC)OC

STK551747
Synonyms: 2- {[4- oxo- 3- (prop- 2- en- 1- yl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N- (2- phenylethyl)acetamide
Smiles: C=CCn1c(SCC(=O)NCCc2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551748
Synonyms: 5- (4- butoxyphenyl)- 3- (3- nitrophenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: CCCCOc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1cccc(c1)[N+](=O)[O-]

STK551750
Synonyms: N- benzyl- 2- imino- 1,10- dimethyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: O=C(c1cc2c(n(c1=N)C)nc1n(c2=O)cccc1C)NCc1ccccc1

STK551751
Synonyms: butyl4- {[(1E)- 8- hydroxy- 4- oxo- 3- (pyrrolidin- 1- yl)naphthalen- 1(4H)- ylidene]amino}benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)/N=C/1\C=C(N2CCCC2)C(=O)c2c1c(O)ccc2

STK551752
Synonyms: 2- {(E)- 2- [4- (dimethylamino)phenyl]ethenyl}- 6- iodo- 3- (naphthalen- 1- yl)quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(cc1)N(C)C)c1cccc2c1cccc2

STK551753
Synonyms: N- (3,4- difluorophenyl)- 2- (2- fluorophenyl)quinazolin- 4- amine
Smiles: Fc1cc(ccc1F)Nc1nc(nc2c1cccc2)c1ccccc1F

STK551754
Synonyms: 2- (4- chlorophenyl)- 3- {5- [2- (propan- 2- yloxy)phenoxy]pentyl}quinazolin- 4(3H)- one
Smiles: CC(Oc1ccccc1OCCCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl)C

STK551757
Synonyms: methyl4- {6- [(2- ethoxyphenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}benzoate
Smiles: CCOc1ccccc1Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(=O)OC)c(nn1c1ccccc1)C

STK551758
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(1E)- 1- [4- (2- methylpropyl)phenyl]ethylidene}- 5- (3- nitrophenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CC(Cc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)/C)C

STK551760
Synonyms: 2- {[5- (methylsulfanyl)- 10- (propan- 2- yl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1cccc4c1cccc4)nn2)CC(OC3)C(C)C

STK551761
Synonyms: 3- [6- (4- chloro- 3- methylphenoxy)hexyl]- 2- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCCOc1ccc(c(c1)C)Cl

STK551763
Synonyms: 2,2- diphenyl- N- (tetrahydrofuran- 2- ylmethyl)cyclopropanecarboxamide
Smiles: O=C(C1CC1(c1ccccc1)c1ccccc1)NCC1CCCO1

STK551766
Synonyms: 1- (furan- 2- yl)- N- (thiophen- 2- ylmethyl)but- 3- en- 1- amine
Smiles: C=CCC(c1ccco1)NCc1cccs1

STK551768
Synonyms: 2- (4- ethylphenyl)- 9- (4- fluorophenyl)tetrahydro- 5H- pyrazolo[1,2- a]pyrrolo[3,4- c]pyrazole- 1,3(2H,3aH)- dione
Smiles: CCc1ccc(cc1)N1C(=O)C2C(C1=O)N1N(C2c2ccc(cc2)F)CCC1

STK551769
Synonyms: 1- amino- N- (4- methylphenyl)- 5- (morpholin- 4- yl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1

STK551770
Synonyms: 5- (2,4- dimethylphenyl)- 3- (3- nitrophenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1cccc(c1)[N+](=O)[O-]

STK551771
Synonyms: 5H- dibenzo[b,f]azepine- 5- carbonylchloride
Smiles: ClC(=O)N1c2ccccc2C=Cc2c1cccc2

STK551773
Synonyms: 1- [3- phenyl- 5- (thiophen- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]ethanone
Smiles: CC(=O)N1N=C(CC1c1cccs1)c1ccccc1

STK551775
Synonyms: ethyl5- bromo- 3- {[3- (4- phenylpiperazin- 1- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1)cc(cc2)Br

STK551776
Synonyms: 1- phenyl- 1H- tetrazol- 5- yl(1E)- N- (4- methylphenyl)- 2- oxopropanehydrazonothioate
Smiles: Cc1ccc(cc1)N/N=C(\C(=O)C)/Sc1nnnn1c1ccccc1

STK551779
Synonyms: 2- [(2- methylbenzyl)sulfanyl]- 3- (2- methylprop- 2- en- 1- yl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CC(=C)Cn1c(SCc2ccccc2C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551781
Synonyms: 2- [(4- amino- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nc(N)c2c(n1)sc1c2CC(OC1)(C)C

STK551783
Synonyms: N~2~,N~2~- diethyl- N~4~- (furan- 2- ylmethyl)- 5- nitropyrimidine- 2,4,6- triamine
Smiles: CCN(c1nc(NCc2ccco2)c(c(n1)N)[N+](=O)[O-])CC

STK551784
Synonyms: 4- bromo- 2- ({[2- (naphthalen- 2- yl)imidazo[1,2- a]pyridin- 3- yl]imino}methyl)phenol
Smiles: Brc1ccc(c(c1)/C=N/c1c(nc2n1cccc2)c1ccc2c(c1)cccc2)O

STK551785
Synonyms: 3- (2- hydroxy- 3,4- dimethylphenyl)- 3- phenyl- N- (2- phenylethyl)propanamide
Smiles: O=C(CC(c1ccc(c(c1O)C)C)c1ccccc1)NCCc1ccccc1

STK551786
Synonyms: 3,3'- [benzene- 1,3- diylbis(oxy)]bis[1- (piperidin- 1- yl)propan- 2- ol]
Smiles: OC(CN1CCCCC1)COc1cccc(c1)OCC(CN1CCCCC1)O

STK551787
Synonyms: 11- [2- (4- methoxyphenyl)ethyl]- 2- methyl- 3- (2- phenylethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccc(cc1)CCn1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)CCc1ccccc1

STK551788
Synonyms: 1- (1- benzyl- 5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- {4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)C/C=C/c1ccccc1)c(n2Cc1ccccc1)C

STK551790
Synonyms: diethyl2,2'- (2,2',4,4'- tetraoxo- 5,5'- bi- 1,3- thiazolidine- 3,3'- diyl)diacetate
Smiles: CCOC(=O)CN1C(=O)SC(C1=O)C1SC(=O)N(C1=O)CC(=O)OCC

STK551791
Synonyms: N- [3- (dibenzylamino)- 2- hydroxypropyl]- N- (4- methylphenyl)- 4- nitrobenzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)C)CN(Cc1ccccc1)Cc1ccccc1

STK551792
Synonyms: 4- amino- N'- [(E)- (2,5- dimethoxyphenyl)methylidene]- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: COc1ccc(cc1/C=N/N=C(/c1nonc1N)\N)OC

STK551793
Synonyms: N- carbamoyl- 4- ({(E)- 2- cyano- 2- [4- (4- ethylphenyl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzenesulfonamide
Smiles: N#C/C(=C\Nc1ccc(cc1)S(=O)(=O)NC(=O)N)/c1scc(n1)c1ccc(cc1)CC

STK551795
Synonyms: 2- [(2- methylbenzyl)sulfanyl]- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCn1c(SCc2ccccc2C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551796
Synonyms: N- (12- cyanoindolizino[2,3- b]quinoxalin- 3- yl)- 4- fluorobenzamide
Smiles: N#Cc1c2ccc(cn2c2c1nc1ccccc1n2)NC(=O)c1ccc(cc1)F

STK551797
Synonyms: 2- {[3- (4- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551798
Synonyms: 14- (3,4- diethoxyphenyl)- 2,3- diethoxy- 13- (morpholin- 4- ylmethyl)- 5,6- dihydrobenzo[6,7]indolo[2,1- a]isoquinolin- 12- ol
Smiles: CCOc1cc(ccc1OCC)c1c2c(CN3CCOCC3)c(O)c3c(c2n2c1c1cc(OCC)c(cc1CC2)OCC)cccc3

STK551799
Synonyms: methyl(2Z)- [2- (3- chlorophenyl)hydrazinylidene][(4,5- diphenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]ethanoate
Smiles: COC(=O)/C(=N/Nc1cccc(c1)Cl)/Sc1nnc(n1c1ccccc1)c1ccccc1

STK551800
Synonyms: 11- (1,3- benzodioxol- 5- ylmethyl)- 2- ethyl- 3- (prop- 2- en- 1- yl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: C=CCn1c(CC)nc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccc2c(c1)OCO2

STK551801
Synonyms: ethyl3- {[3- (4- benzylpiperidin- 1- yl)propanoyl]amino}- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCC(CC1)Cc1ccccc1)cc(c(c2)OC)OC

STK551802
Synonyms: N- [2- (dimethylamino)ethyl]- 9- fluoro- 7- hydroxy- 3- methyl- 5- oxo- 2,3- dihydro- 1H,5H- pyrido[3,2,1- ij]quinoline- 6- carboxamide
Smiles: CN(CCNC(=O)c1c(O)c2cc(F)cc3c2n(c1=O)C(C)CC3)C

STK551803
Synonyms: ethyl4- {[11- (4- ethylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)CC)C)c1ccccc1

STK551804
Synonyms: 2- [(3- fluorobenzyl)sulfanyl]- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: Fc1cccc(c1)CSc1nc(N)c2c(n1)sc1c2CC(OC1)(C)C

STK551805
Synonyms: (2Z)- N- (3- chlorophenyl)- 2- cyano- 2- [(5Z)- 5- (2- methoxybenzylidene)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]ethanamide
Smiles: COc1ccccc1/C=c/1\s/c(=C(\C(=O)Nc2cccc(c2)Cl)/C#N)/n(c1=O)c1ccccc1

STK551806
Synonyms: 5- ethyl- 3- (hexylsulfanyl)- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCCCCCSc1nnc2n1c(CC)nc1c2c2CC(C)(C)OCc2s1

STK551807
Synonyms: 3- (2- methylpropyl)- 2- (prop- 2- yn- 1- ylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: C#CCSc1nc2c3ccccc3CC3(c2c(=O)n1CC(C)C)CCCC3

STK551808
Synonyms: 2- amino- 1- (3- methylbutyl)- N- (tetrahydrofuran- 2- ylmethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CC(CCn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCC1CCCO1)C

STK551809
Synonyms: 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N,N- dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3)CCC

STK551811
Synonyms: 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: O=C(N(c1ccccc1)c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK551812
Synonyms: (8R,8aS,11aR)- 10- (2,5- dimethoxyphenyl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1cc(OC)ccc1OC)cccc3

STK551814
Synonyms: 3- {5- [(3- chlorobenzyl)sulfanyl]- 4- (4- ethoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}pyridine
Smiles: CCOc1ccc(cc1)n1c(SCc2cccc(c2)Cl)nnc1c1cccnc1

STK551815
Synonyms: (6aS,6bR,9aS,10R)- 10- [(4- chlorophenyl)carbonyl]- 8- [2- (trifluoromethyl)phenyl]- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccccc1C(F)(F)F)C=Cc1c2cccc1

STK551816
Synonyms: ethyl2- ({[(4- amino- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl)sulfanyl]acetyl}amino)- 4,5- dimethylthiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc(N)c3c(n2)sc2c3CCCC2)sc(c1C)C

STK551817
Synonyms: 2- (pyridin- 2- yl)- N- [3- (trifluoromethyl)phenyl]quinazolin- 4- amine
Smiles: FC(c1cccc(c1)Nc1nc(nc2c1cccc2)c1ccccn1)(F)F

STK551818
Synonyms: (5E)- 1- (3- chloro- 4- methylphenyl)- 5- (4- methoxy- 3- nitrobenzylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1[N+](=O)[O-])/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(c(c1)Cl)C

STK551819
Synonyms: N- [(1E)- 3- {[2- (1H- indol- 3- yl)ethyl]amino}- 1- (4- methoxyphenyl)- 3- oxoprop- 1- en- 2- yl]thiophene- 2- carboxamide
Smiles: COc1ccc(cc1)/C=C(\C(=O)NCCc1c[nH]c2c1cccc2)/NC(=O)c1cccs1

STK551821
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1

STK551825
Synonyms: 2- amino- N- (3- methoxypropyl)- 1- (2- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccccc1

STK551826
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 11- (3- chlorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(cc1Cl)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)Cl)c(nn1c1ccccc1)C

STK551827
Synonyms: (1'S,2'S,3R,3a'R)- 2'- [(2,5- dimethoxyphenyl)carbonyl]- 1'- (2,2- dimethylpropanoyl)- 1',2'- dihydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: COc1ccc(c(c1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C)OC

STK551828
Synonyms: ethyl(2Z)- 3,4- dihydroquinolin- 1(2H)- yl[2- (3- nitrophenyl)hydrazinylidene]ethanoate
Smiles: CCOC(=O)/C(=N/Nc1cccc(c1)[N+](=O)[O-])/N1CCCc2c1cccc2

STK551829
Synonyms: 5- (decylsulfanyl)- 3- octyl- 1H- 1,2,4- triazole
Smiles: CCCCCCCCCCSc1[nH]nc(n1)CCCCCCCC

STK551830
Synonyms: 2- (4- butoxyphenyl)- 6,6- dimethyl- 4- [(3- methylbutyl)sulfanyl]- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCCCOc1ccc(cc1)c1nc(SCCC(C)C)c2c(n1)sc1c2CC(OC1)(C)C

STK551832
Synonyms: 3- (4- methoxyphenyl)- 2- [(3- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: COc1ccc(cc1)n1c(SCc2cccc(c2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK551834
Synonyms: 5- ethyl- 3- (methylsulfanyl)- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCc1nc2sc3c(c2c2n1c(SC)nn2)CCC3

STK551837
Synonyms: 1- [3,3- bis(4- chlorophenyl)- 3'- phenyl- 3H,3'H- spiro[2- benzothiophene- 1,2'- [1,3,4]thiadiazol]- 5'- yl]ethanone
Smiles: Clc1ccc(cc1)C1(SC2(c3c1cccc3)SC(=NN2c1ccccc1)C(=O)C)c1ccc(cc1)Cl

STK551839
Synonyms: 7- ({2- [benzyl(methyl)amino]ethyl}amino)- 3- methyl- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: CN(Cc1ccccc1)CCNc1cc2oc3cc(C)ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1

STK551840
Synonyms: (8S,8aR,11aS,11bS)- 8- (2,2- dimethylpropanoyl)- 10- (2- fluorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Fc1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)C(C)(C)C)C=Cc2c1cccc2

STK551842
Synonyms: (2E)- 2- [4- (4- fluorophenyl)- 1,3- thiazol- 2- yl]- 3- [(5- methoxy- 2- methyl- 4- nitrophenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(cc1C)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1)F

STK551843
Synonyms: methyl4- [5- (4- methylphenyl)- 4,6- dioxo- 2- phenylhexahydro- 2H- pyrrolo[3,4- d][1,2]oxazol- 3- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)C)c1ccccc1

STK551844
Synonyms: 5,7- diiodoquinolin- 8- ylpiperidine- 1- carboxylate
Smiles: O=C(N1CCCCC1)Oc1c(I)cc(c2c1nccc2)I

STK551845
Synonyms: N- {2- oxo- 2- [(2E)- 2- (1- phenylpropan- 2- ylidene)hydrazinyl]ethyl}pyridine- 3- carboxamide(non- preferredname)
Smiles: O=C(CNC(=O)c1cccnc1)N/N=C(/Cc1ccccc1)\C

STK551846
Synonyms: 2- (ethylsulfanyl)- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCn1c(SCC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551847
Synonyms: N- {[2- (1,3- benzodioxol- 5- ylcarbonyl)hydrazinyl]carbonothioyl}- 3,4,5- trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)NC(=S)NNC(=O)c1ccc2c(c1)OCO2

STK551848
Synonyms: 4- (4- methylphenyl)- 1- [(naphthalen- 2- ylmethyl)sulfanyl]- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Cc1ccc(cc1)n1c(=O)c2c3CCCc3sc2n2c1nnc2SCc1ccc2c(c1)cccc2

STK551849
Synonyms: 2- (4- chlorophenyl)- 3- [6- (2- ethoxyphenoxy)hexyl]quinazolin- 4(3H)- one
Smiles: CCOc1ccccc1OCCCCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK551851
Synonyms: 11- (4- ethylphenyl)- 10- methyl- N- (3- methylphenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cccc(c1)C)nc1c2cccc1

STK551852
Synonyms: 4- [4- (3- chlorophenyl)piperazin- 1- yl]- 2- (3,4- dimethoxyphenyl)- 7- ethoxy- 6- methoxyquinazoline
Smiles: CCOc1cc2nc(nc(c2cc1OC)N1CCN(CC1)c1cccc(c1)Cl)c1ccc(c(c1)OC)OC

STK551853
Synonyms: (5Z)- 1- [4- (butan- 2- yl)phenyl]- 5- {[1- (4- methylbenzyl)- 1H- indol- 3- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccc(cc2)C)/C1=O)C

STK551854
Synonyms: N~4~- (2- fluorophenyl)- 5- nitro- N~2~- (tetrahydrofuran- 2- ylmethyl)pyrimidine- 2,4,6- triamine
Smiles: [O-][N+](=O)c1c(N)nc(nc1Nc1ccccc1F)NCC1CCCO1

STK551855
Synonyms: 3- (furan- 2- ylmethyl)- 2- [(3- methylbutyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CC(CCSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3)C

STK551856
Synonyms: 4- butyl- 7- [(4- fluorobenzyl)sulfanyl]- 2,3,5a,10b- tetrahydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncnc3SCc1ccc(cc1)F

STK551858
Synonyms: 2- [(4- methylbenzyl)sulfanyl]- 3- (2- methylprop- 2- en- 1- yl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CC(=C)Cn1c(SCc2ccc(cc2)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551859
Synonyms: 2- [(2- phenylethyl)sulfanyl]- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCn1c(SCCc2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551860
Synonyms: 5- [(4- butoxy- 3- nitrobenzyl)sulfanyl]- 2- methyl- 4- nitro- 1H- imidazole
Smiles: CCCCOc1ccc(cc1[N+](=O)[O-])CSc1[nH]c(nc1[N+](=O)[O-])C

STK551861
Synonyms: N,N- diethyl- N'- [11- (2- methoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]benzene- 1,4- diamine
Smiles: COc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1)N(CC)CC)c1ccccc1

STK551862
Synonyms: 12- [(2- chlorobenzyl)oxy]- 14- (3,4- diethoxyphenyl)- 2,3- diethoxy- 5,6- dihydrobenzo[6,7]indolo[2,1- a]isoquinoline
Smiles: CCOc1cc(ccc1OCC)c1c2cc(OCc3ccccc3Cl)c3c(c2n2c1c1cc(OCC)c(cc1CC2)OCC)cccc3

STK551863
Synonyms: N- (4- methylphenyl)- 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: CC(=C)Cn1c(SCC(=O)Nc2ccc(cc2)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551864
Synonyms: ethyl5- methoxy- 3- ({3- [4- (2- methoxyphenyl)piperazin- 1- yl]propanoyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1OC)cc(cc2)OC

STK551865
Synonyms: N- (4- butylphenyl)- 11- (4- ethylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCCCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)CC)C)c1ccccc1

STK551866
Synonyms: N- [2- hydroxy- 3- (piperidin- 1- yl)propyl]- 2- nitro- N- phenylbenzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1)CN1CCCCC1

STK551867
Synonyms: 2- {[7,7- dimethyl- 4- (3- methylphenyl)- 5- oxo- 4,5,6,9- tetrahydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CC(OC3)(C)C

STK551868
Synonyms: 2- [4- (2- hydroxyethyl)piperazin- 1- yl]- 1- (5- methoxy- 2- methyl- 1H- indol- 3- yl)ethanone
Smiles: OCCN1CCN(CC1)CC(=O)c1c(C)[nH]c2c1cc(OC)cc2

STK551871
Synonyms: 3- (3- methylphenyl)- 2- (prop- 2- yn- 1- ylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: C#CCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCC3

STK551872
Synonyms: 4- [(2- chlorobenzyl)sulfanyl]- 2- (methylsulfanyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine
Smiles: CSc1nc(SCc2ccccc2Cl)c2c(n1)sc1c2CCCC1

STK551873
Synonyms: 2- {[6,6- dimethyl- 3- (4- methylphenyl)- 4- oxo- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- (1- phenylpropan- 2- yl)acetamide
Smiles: CC(Cc1ccccc1)NC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(OC3)(C)C

STK551874
Synonyms: 3- methyl- 7- {[2- (4- phenylpiperazin- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: Cc1ccc2c(c1)oc1c([nH]2)c2c(c(c1)NCCN1CCN(CC1)c1ccccc1)c(=O)c1c(c2=O)cccc1

STK551875
Synonyms: 6- hydroxy- 5- (7- hydroxy- 6- methyl- 1,3- dihydrofuro[3,4- c]pyridin- 5- ium- 1- yl)- 4- oxo- 1- phenyl- 1,4- dihydropyrimidine- 2- thiolate
Smiles: O=c1nc([S-])n(c(c1C1OCc2c1c(O)c([nH+]c2)C)O)c1ccccc1

STK551876
Synonyms: N- [3- (dibutylamino)- 2- hydroxypropyl]- N- phenylbenzenesulfonamide
Smiles: CCCCN(CC(CN(S(=O)(=O)c1ccccc1)c1ccccc1)O)CCCC

STK551878
Synonyms: (5E)- 1- (3- chloro- 4- methylphenyl)- 5- (2- methoxybenzylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccccc1/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(c(c1)Cl)C

STK551880
Synonyms: 1- [3- (dimethylamino)propyl]- 7,7- dimethyl- 2- phenyl- 1,5,7,8- tetrahydro- 4H- pyrano[4,3- d]pyrimidine- 4- thione
Smiles: CN(CCCn1c(nc(=S)c2c1CC(C)(C)OC2)c1ccccc1)C

STK551881
Synonyms: 4- hydroxy- N- [(5Z)- 4- oxo- 5- (pyridin- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]benzamide
Smiles: Oc1ccc(cc1)C(=O)NN1C(=S)S/C(=C\c2ccccn2)/C1=O

STK551882
Synonyms: 6- {[(2E)- 3- (3,4- diethoxyphenyl)- 2- {[(2- methylphenyl)carbonyl]amino}prop- 2- enoyl]amino}hexanoicacid
Smiles: CCOc1cc(ccc1OCC)/C=C(\C(=O)NCCCCCC(=O)O)/NC(=O)c1ccccc1C

STK551885
Synonyms: 6- chloro- 4- phenyl- 2- [3- phenyl- 5- (thiophen- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]quinazoline
Smiles: Clc1ccc2c(c1)c(nc(n2)N1N=C(CC1c1cccs1)c1ccccc1)c1ccccc1

STK551887
Synonyms: (2E)- 3- (3,4- dimethoxyphenyl)- N- [(2- {[(1S,2S)- 2- phenylcyclopropyl]carbonyl}hydrazinyl)carbonothioyl]prop- 2- enamide
Smiles: COc1cc(/C=C/C(=O)NC(=S)NNC(=O)[C@H]2C[C@@H]2c2ccccc2)ccc1OC

STK551891
Synonyms: 6- {[(2E)- 3- (3,4- diethoxyphenyl)- 2- {[(4- methoxyphenyl)carbonyl]amino}prop- 2- enoyl]amino}hexanoicacid
Smiles: CCOc1cc(ccc1OCC)/C=C(\C(=O)NCCCCCC(=O)O)/NC(=O)c1ccc(cc1)OC

STK551892
Synonyms: (8R,8aS,11aR)- 8- [(4- methoxyphenyl)carbonyl]- 10- (4- methylphenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)C)cccc3

STK551893
Synonyms: 2- (pentylsulfanyl)- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCn1c(SCCCCC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551895
Synonyms: 2- [(3- benzyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl)sulfanyl]- N,N- dibutylacetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCC3)CCCC

STK551896
Synonyms: 3- butyl- 2- (ethylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCCn1c(SCC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551897
Synonyms: 2- [(5- oxo- 4- phenyl- 4,5,6,7,8,9- hexahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl)sulfanyl]- N- (1- phenylpropan- 2- yl)acetamide
Smiles: O=C(NC(Cc1ccccc1)C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCC3

STK551898
Synonyms: N- (3- chloro- 2- methylphenyl)- 2- {[4- (4- ethoxyphenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2C)Cl)nnc1c1cccnc1

STK551899
Synonyms: 3- ethyl- 2- (heptylsulfanyl)- 6- iodoquinazolin- 4(3H)- one
Smiles: CCCCCCCSc1nc2ccc(cc2c(=O)n1CC)I

STK551900
Synonyms: (8R,8aS,11aR)- 10- (4- bromophenyl)- 8- (2,2- dimethylpropanoyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: Brc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1C2c2ccccc2C=N1)C(=O)C(C)(C)C

STK551901
Synonyms: N- benzyl- 2- {[8,8- dimethyl- 11- (morpholin- 4- yl)- 7,10- dihydro- 8H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[2,3- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}acetamide
Smiles: O=C(NCc1ccccc1)CSc1nnc2n1cnc1c2sc2c1c1CC(C)(C)OCc1c(n2)N1CCOCC1

STK551903
Synonyms: 3- (3,4- dimethoxybenzyl)- 8- fluoro- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cc(ccc1OC)Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)F

STK551906
Synonyms: N'- {[(7,8- dimethoxyphthalazin- 1- yl)sulfanyl]acetyl}- 2- methylbenzohydrazide
Smiles: COc1c(OC)ccc2c1c(nnc2)SCC(=O)NNC(=O)c1ccccc1C

STK551908
Synonyms: 5- chloro- 4- (2- chloro- 10H- phenothiazin- 10- yl)- N- (2,3- dimethylphenyl)- 3,6- difluoropyridin- 2- amine
Smiles: Clc1ccc2c(c1)N(c1c(F)c(nc(c1Cl)F)Nc1cccc(c1C)C)c1c(S2)cccc1

STK551909
Synonyms: (2E)- 2- [4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]- 3- {[2- (trifluoromethyl)phenyl]amino}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1C(F)(F)F)/c1scc(n1)c1ccc(cc1)OC

STK551912
Synonyms: 2- (ethoxycarbonyl)phenyl1- chloro- 4- (4- chlorophenyl)- 2- [(2- nitrophenyl)sulfanyl]- 2,3,3a,4,5,9b- hexahydro- 1H- cyclopenta[c]quinoline- 8- carboxylate
Smiles: CCOC(=O)c1ccccc1OC(=O)c1ccc2c(c1)C1C(Cl)C(CC1C(N2)c1ccc(cc1)Cl)Sc1ccccc1[N+](=O)[O-]

STK551913
Synonyms: 2- (2- {[5- (methylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}ethyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: CSc1nc2sc3c(c2c2n1c(SCCN1C(=O)c4c(C1=O)cccc4)nn2)CCCC3

STK551914
Synonyms: 2- {[4- (4- bromophenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N,N- diethylacetamide
Smiles: CCN(C(=O)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1)CC

STK551915
Synonyms: 2- [(5- oxo- 4- phenyl- 4,5,6,7,8,9- hexahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl)sulfanyl]- N- (2- phenylethyl)acetamide
Smiles: O=C(CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCC3)NCCc1ccccc1

STK551917
Synonyms: 1- (2- chloro- 10H- phenothiazin- 10- yl)- 2- (dimethylamino)ethanone
Smiles: CN(CC(=O)N1c2ccccc2Sc2c1cc(Cl)cc2)C

STK551918
Synonyms: ethyl3- {[2- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl)propanoyl]amino}- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C(N1CCC3(CC1)OCCO3)C)cc(c(c2)OC)OC

STK551919
Synonyms: 1- [(2- chlorobenzyl)sulfanyl]- 4- (4- methylphenyl)- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CC(C1OCc2c(C1)c1c(s2)n2c(SCc3ccccc3Cl)nnc2n(c1=O)c1ccc(cc1)C)C

STK551925
Synonyms: 4- {6- [(4- ethylphenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}benzene- 1,2- diol
Smiles: CCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(c(c2)O)O)c(nn1c1ccccc1)C

STK551926
Synonyms: (1'R,2'R,3a'S)- 2'- (4- bromophenyl)- 1'- (2,2- dimethylpropanoyl)- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: Brc1ccc(cc1)[C@H]1[C@@H](N2[C@H]([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C

STK551927
Synonyms: ethyl3- ({3- [4- (4- fluorophenyl)piperazin- 1- yl]propanoyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccc(cc1)F)cccc2

STK551928
Synonyms: 3- propyl- 2- (prop- 2- yn- 1- ylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCn1c(SCC#C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551929
Synonyms: 5- (2- chlorophenyl)- 3- [(2,4- dichlorobenzyl)sulfanyl]- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: Clc1ccc(c(c1)Cl)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1Cl

STK551931
Synonyms: 3- benzyl- 2- [(2- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Cc1ccccc1CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3

STK551932
Synonyms: 3- (4- hydroxyphenyl)- 2- phenyl- 5- (4- propoxyphenyl)dihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: CCCOc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(cc1)O

STK551933
Synonyms: 11- (3,4- dichlorophenyl)- 3- (3,5- dimethylphenyl)- 2- methyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Cc1cc(C)cc(c1)n1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)Cl)Cl

STK551934
Synonyms: ethyl4- (5- {(E)- [(7,8- dimethoxy- 2,4- dioxo- 1,2,4,5- tetrahydro- 3H- pyrimido[5,4- b]indol- 3- yl)imino]methyl}furan- 2- yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(c(c1)OC)OC

STK551935
Synonyms: (2'R,3'R)- 2'- (2,5- dimethoxyphenyl)- 3'- (phenylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: COc1ccc(c(c1)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2)OC

STK551936
Synonyms: 1- amino- N- (furan- 2- ylmethyl)- 5- (morpholin- 4- yl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1)NCc1ccco1

STK551937
Synonyms: 4,6- bis(4- chlorophenyl)- 2- phenylpyrimidine
Smiles: Clc1ccc(cc1)c1cc(nc(n1)c1ccccc1)c1ccc(cc1)Cl

STK551938
Synonyms: 2- (2- {[6,6- dimethyl- 3- (3- methylphenyl)- 4- oxo- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}ethyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: Cc1cccc(c1)n1c(SCCN2C(=O)c3c(C2=O)cccc3)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK551939
Synonyms: 11- (4- tert- butylphenyl)- N- (2- ethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccccc1Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(C)(C)C)c(nn1c1ccccc1)C

STK551940
Synonyms: (5Z)- 5- (2- methoxybenzylidene)- 3- (naphthalen- 2- yl)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1ccccc1/C=C/1\SC(=S)N(C1=O)c1ccc2c(c1)cccc2

STK551942
Synonyms: N- (3- methylphenyl)- 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK551943
Synonyms: 2- (4- methylphenyl)- 3- [(4- nitrophenyl)sulfonyl]- 1,3- thiazolidine
Smiles: Cc1ccc(cc1)C1SCCN1S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

STK551945
Synonyms: (8R,8aS,11aR)- 8- [(4- methoxyphenyl)carbonyl]- 10- (2- methyl- 4- nitrophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-])cccc3

STK551948
Synonyms: ethyl[(4- oxo- 3- propyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl)sulfanyl]acetate
Smiles: CCCn1c(SCC(=O)OCC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551950
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 3- ethyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCn1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK551952
Synonyms: 3- [4- (4- ethoxyphenyl)- 5- {[3- (trifluoromethyl)benzyl]sulfanyl}- 4H- 1,2,4- triazol- 3- yl]pyridine
Smiles: CCOc1ccc(cc1)n1c(nnc1c1cccnc1)SCc1cccc(c1)C(F)(F)F

STK551953
Synonyms: (2E)- 3- {[4- chloro- 2- (trifluoromethyl)phenyl]amino}- 2- [4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C(F)(F)F)Cl)/c1scc(n1)c1ccc(cc1)OC

STK551955
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (2- methylpropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)CC(C)C)C

STK551956
Synonyms: 4- phenyl- 5H- pyridazino[4,5- b]indole- 1- thiol
Smiles: Sc1nnc(c2c1c1ccccc1[nH]2)c1ccccc1

STK551957
Synonyms: 3,3'- (furan- 2- ylmethanediyl)bis(1,5- dioxaspiro[5.5]undecane- 2,4- dione)
Smiles: O=C1OC2(CCCCC2)OC(=O)C1C(C1C(=O)OC2(OC1=O)CCCCC2)c1ccco1

STK551959
Synonyms: 3- [(2- chlorobenzyl)sulfanyl]- 5- ethyl- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCc1nc2sc3c(c2c2n1c(SCc1ccccc1Cl)nn2)CC(OC3)(C)C

STK551961
Synonyms: 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)- 1- (5- methoxy- 2- methyl- 1H- indol- 3- yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCc3c(C1)cc(c(c3)OC)OC)c([nH]2)C

STK551962
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [2- (benzyloxy)- 3- methoxyphenyl]methylidene}- 5- (morpholin- 4- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cccc(c1OCc1ccccc1)/C=N/NC(=O)c1nnn(c1CN1CCOCC1)c1nonc1N

STK551963
Synonyms: N- (4- fluorophenyl)- 2- [4- (propan- 2- yloxy)phenyl]quinazolin- 4- amine
Smiles: CC(Oc1ccc(cc1)c1nc(Nc2ccc(cc2)F)c2c(n1)cccc2)C

STK551965
Synonyms: 1- (1- benzyl- 5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- (4- benzylpiperidin- 1- yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCC(CC1)Cc1ccccc1)c(n2Cc1ccccc1)C

STK551967
Synonyms: 12- hexyl- 9- (hexylsulfanyl)- 5H- spiro[benzo[h][1,2,4]triazolo[3,4- b]quinazoline- 6,1'- cyclopentan]- 7(12H)- one
Smiles: CCCCCCSc1nnc2n1c(=O)c1c(n2CCCCCC)c2ccccc2CC21CCCC2

STK551968
Synonyms: 3- (4- bromophenyl)- 5- [4- (propan- 2- yl)phenyl]- 3a,6a- dihydrospiro[furo[3,4- c]pyrrole- 1,2'- indene]- 1',3',4,6(3H,5H)- tetrone
Smiles: Brc1ccc(cc1)C1OC2(C3C1C(=O)N(C3=O)c1ccc(cc1)C(C)C)C(=O)c1c(C2=O)cccc1

STK551969
Synonyms: 3- methyl- N- [2- (naphthalen- 2- yl)imidazo[1,2- a]pyridin- 3- yl]butanamide
Smiles: CC(CC(=O)Nc1c(nc2n1cccc2)c1ccc2c(c1)cccc2)C

STK551970
Synonyms: (5Z)- 2- [(3,4- dimethylphenyl)amino]- 5- (3,4,5- trimethoxybenzylidene)- 1,3- thiazol- 4(5H)- one
Smiles: COc1cc(/C=C/2\SC(=NC2=O)Nc2ccc(c(c2)C)C)cc(c1OC)OC

STK551972
Synonyms: 2- {[10,10- dimethyl- 5- (methylsulfanyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1cccc4c1cccc4)nn2)CC(OC3)(C)C

STK551973
Synonyms: 4- (3- methylphenyl)- 1- [(naphthalen- 2- ylmethyl)sulfanyl]- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CC(C1OCc2c(C1)c1c(s2)n2c(SCc3ccc4c(c3)cccc4)nnc2n(c1=O)c1cccc(c1)C)C

STK551976
Synonyms: N- (3,4- difluorophenyl)- 2- [4- (propan- 2- yloxy)phenyl]quinazolin- 4- amine
Smiles: CC(Oc1ccc(cc1)c1nc(Nc2ccc(c(c2)F)F)c2c(n1)cccc2)C

STK551977
Synonyms: N- {3- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]quinoxalin- 2- yl}- 4- methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK551978
Synonyms: 2- [(1,3- dioxolan- 2- ylmethyl)(methyl)amino]- 1- (5- methoxy- 2- methyl- 1H- indol- 3- yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN(CC1OCCO1)C)c([nH]2)C

STK551979
Synonyms: 2- ({4- amino- 6- [(3- methylphenyl)amino]- 5- nitropyrimidin- 2- yl}amino)ethanol
Smiles: OCCNc1nc(Nc2cccc(c2)C)c(c(n1)N)[N+](=O)[O-]

STK551980
Synonyms: methyl1- acetyl- 7- (3- bromophenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: COC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1cccc(c1)Br)C(=O)C

STK551981
Synonyms: 11- [4- (dimethylamino)phenyl]- N- (4- ethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)N(C)C)c(nn1c1ccccc1)C

STK551982
Synonyms: 4- [5- (trifluoromethyl)- 1,3,4- thiadiazol- 2- yl]morpholine
Smiles: FC(c1nnc(s1)N1CCOCC1)(F)F

STK551984
Synonyms: N- [3- (dimethylamino)- 2- hydroxypropyl]- N- (4- methoxyphenyl)- 4- methylbenzenesulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)C)CC(CN(C)C)O

STK551987
Synonyms: N- [2- hydroxy- 3- (pyrrolidin- 1- yl)propyl]- N- (4- methylphenyl)naphthalene- 2- sulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccc2c(c1)cccc2)c1ccc(cc1)C)CN1CCCC1

STK551989
Synonyms: 3- (2,5- dimethylphenyl)- 11- (3,5- dimethylphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Cc1cc(C)cc(c1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)c1cc(C)ccc1C

STK551990
Synonyms: N'- [(E)- (2- hydroxy- 5- nitrophenyl)methylidene]- 2- oxopiperidine- 3- carbohydrazide
Smiles: [O-][N+](=O)c1cc(/C=N/NC(=O)C2CCCNC2=O)c(cc1)O

STK551991
Synonyms: ethyl7- [(1,4- dioxa- 8- azaspiro[4.5]dec- 8- ylacetyl)amino]- 5H- [1,3]dioxolo[4,5- f]indole- 6- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCC3(CC1)OCCO3)cc1c(c2)OCO1

STK551992
Synonyms: 1- [(2,6- dichlorobenzyl)sulfanyl]- 4- (4- methoxyphenyl)- 7,7- dimethyl- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CC(C)(C)OCc1s2)SCc1c(Cl)cccc1Cl

STK551993
Synonyms: 11- (3- chlorophenyl)- N- (4- ethylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)Cl)c(nn1c1ccccc1)C

STK551994
Synonyms: 2- amino- N- (prop- 2- en- 1- yl)- 1- (3,4,5- trimethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: C=CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(OC)c(c(c1)OC)OC

STK551995
Synonyms: 2- [(3- methylbenzyl)sulfanyl]- 3- (2- phenylethyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Cc1cccc(c1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3

STK551996
Synonyms: (2E)- 2- cyano- 2- [5- (2,5- dichlorobenzyl)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]- N- (2,4- dimethylphenyl)ethanamide
Smiles: N#C/C(=C/1\SC(C(=O)N1c1ccccc1)Cc1cc(Cl)ccc1Cl)/C(=O)Nc1ccc(cc1C)C

STK551997
Synonyms: 3- (2,5- dichlorophenyl)- 11- (3,4- dimethylphenyl)- 2- ethyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCc1nc2n(c3ccc(c(c3)C)C)c3c(c2c(=O)n1c1cc(Cl)ccc1Cl)nc1c(n3)cccc1

STK551998
Synonyms: 6- chloro- 3- [5- (2- fluorophenyl)- 1- (furan- 2- ylcarbonyl)- 4,5- dihydro- 1H- pyrazol- 3- yl]- 4- phenylquinolin- 2(1H)- one
Smiles: Clc1ccc2c(c1)c(c1ccccc1)c(c(=O)[nH]2)C1=NN(C(C1)c1ccccc1F)C(=O)c1ccco1

STK551999
Synonyms: 3- {[3- (1H- benzotriazol- 1- yl)- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl]amino}phenyl2- chlorobenzoate
Smiles: O=C1c2ccccc2C(=O)C(=C1Nc1cccc(c1)OC(=O)c1ccccc1Cl)n1nnc2c1cccc2

STK552000
Synonyms: N- (4- bromophenyl)- 2- [(10- butyl- 7,8,9,11a- tetrahydro- 6bH- cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetamide
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncn1c3nnc1SCC(=O)Nc1ccc(cc1)Br

STK552001
Synonyms: 7,8- dimethyl- 2- (thiophen- 2- yl)- 4- (trifluoromethyl)- 3H- 1,5- benzodiazepine
Smiles: Cc1cc2N=C(CC(=Nc2cc1C)c1cccs1)C(F)(F)F

STK552002
Synonyms: N- (2- methylphenyl)- 2- {[4- oxo- 3- (prop- 2- en- 1- yl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552006
Synonyms: (9E)- 9- (4- chlorobenzylidene)- 5- (4- chlorophenyl)- 3- (4- methoxyphenyl)- 7- methyl- 6,7,8,9- tetrahydro- 5H- pyrido[4,3- d][1,3]thiazolo[3,2- a]pyrimidine
Smiles: COc1ccc(cc1)c1csc2=NC3=C(C(n12)c1ccc(cc1)Cl)CN(C/C/3=C\c1ccc(cc1)Cl)C

STK552007
Synonyms: 11- (4- fluorophenyl)- 10- methyl- N,8- diphenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Fc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccccc1)c1ccccc1

STK552008
Synonyms: 2- [(E)- 2- (3- methylphenyl)ethenyl]- 3- (4- nitrophenyl)quinazolin- 4(3H)- one
Smiles: Cc1cccc(c1)/C=C/c1nc2ccccc2c(=O)n1c1ccc(cc1)[N+](=O)[O-]

STK552009
Synonyms: (6aR,6bS,9aR,10S)- 8- (3- nitrophenyl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: O=C1N(c2cccc(c2)[N+](=O)[O-])C(=O)[C@@H]2[C@H]1[C@H]1C=Cc3c(N1[C@@H]2C(=O)Nc1ccc(cc1)[N+](=O)[O-])cccc3

STK552011
Synonyms: N- [3- (dimethylamino)- 2- hydroxypropyl]- N- (2- methoxy- 5- nitrophenyl)benzenesulfonamide
Smiles: COc1ccc(cc1N(S(=O)(=O)c1ccccc1)CC(CN(C)C)O)[N+](=O)[O-]

STK552013
Synonyms: 4- {[(6aS,6bR,9aS,10R)- 8- (4- butoxyphenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinolin- 10- yl]carbonyl}phenylacetate
Smiles: CCCCOc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)c1ccc(cc1)OC(=O)C

STK552014
Synonyms: N- [3- (dimethylamino)- 2- hydroxypropyl]- N- (3- methylphenyl)benzenesulfonamide
Smiles: CN(CC(CN(S(=O)(=O)c1ccccc1)c1cccc(c1)C)O)C

STK552015
Synonyms: 3- butyl- 2- [(3- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCn1c(SCc2cccc(c2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK552016
Synonyms: 10- (4- bromophenyl)pyrimido[4,5- b]quinoline- 2,4(3H,10H)- dione
Smiles: Brc1ccc(cc1)n1c2ccccc2cc2c1nc(=O)[nH]c2=O

STK552017
Synonyms: 2- (2- bromo- 4,5- diphenyl- 1H- imidazol- 1- yl)- 1- phenylethanone
Smiles: O=C(c1ccccc1)Cn1c(Br)nc(c1c1ccccc1)c1ccccc1

STK552018
Synonyms: (5Z)- 1- (3- chloro- 4- methylphenyl)- 5- {[1- (2- phenoxyethyl)- 1H- indol- 3- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\c1cn(c2c1cccc2)CCOc1ccccc1)c1ccc(c(c1)Cl)C

STK552020
Synonyms: 3,3'- [propane- 2,2- diylbis(benzene- 4,1- diyloxy)]bis[1- (dimethylamino)propan- 2- ol]
Smiles: OC(CN(C)C)COc1ccc(cc1)C(c1ccc(cc1)OCC(CN(C)C)O)(C)C

STK552024
Synonyms: 2- (3,4- dimethoxyphenyl)- 7- ethoxy- 4- [4- (4- fluorophenyl)piperazin- 1- yl]- 6- methoxyquinazoline
Smiles: CCOc1cc2nc(nc(c2cc1OC)N1CCN(CC1)c1ccc(cc1)F)c1ccc(c(c1)OC)OC

STK552026
Synonyms: 2- amino- N- (2,5- dimethylphenyl)- 1- hexyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCCn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1cc(C)ccc1C

STK552027
Synonyms: N,N- diethyl- N'- [11- (2- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]benzene- 1,4- diamine
Smiles: CCN(c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccccc1F)C)c1ccccc1)CC

STK552028
Synonyms: 9- (3,4- dichlorophenyl)- 3- methyl- 1- phenyl- 1H- pyrazolo[4',3':5,6]pyrido[2,3- d]pyrimidine- 5,7(6H,9H)- dione
Smiles: O=c1[nH]c(=O)c2c(n1)n(c1ccc(c(c1)Cl)Cl)c1c(c2)c(nn1c1ccccc1)C

STK552029
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(3- chlorobenzyl)oxy]- 3- ethoxyphenyl}methylidene]- 5- (phenoxymethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2COc2ccccc2)c2nonc2N)ccc1OCc1cccc(c1)Cl

STK552030
Synonyms: N- (naphthalen- 1- yl)- 2- [(11- propyl- 7,8,9,10- tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 3- yl)sulfanyl]acetamide
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncn1c3nnc1SCC(=O)Nc1cccc2c1cccc2

STK552031
Synonyms: 2- {4- [butyl(ethyl)amino]quinazolin- 2- yl}phenol
Smiles: CCCCN(c1nc(nc2c1cccc2)c1ccccc1O)CC

STK552032
Synonyms: 2- chloro- 6- methoxy- 3- [1- (methylsulfonyl)- 3- (thiophen- 2- yl)- 4,5- dihydro- 1H- pyrazol- 5- yl]quinoline
Smiles: COc1ccc2c(c1)cc(c(n2)Cl)C1CC(=NN1S(=O)(=O)C)c1cccs1

STK552035
Synonyms: N'- [(E)- 1H- indol- 3- ylmethylidene]- 2- [(1- methyl- 1H- benzimidazol- 2- yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nc2c(n1C)cccc2)N/N=C/c1c[nH]c2c1cccc2

STK552036
Synonyms: 7'- (4- methoxyphenyl)- 2,2- dimethyl- 6',16'- bis(phenylcarbonyl)- 6',7',8b',8c',16',16a'- hexahydro- 8a'H- spiro[1,3- dioxane- 5,8'- pyrrolo[1,2- a']pyrrolo[1,2- a:3,4- c']diquinoline]- 4,6- dione
Smiles: COc1ccc(cc1)C1C(C(=O)c2ccccc2)N2C(C31C(=O)OC(OC3=O)(C)C)C1C3C=Cc4c(N3C(C1c1c2cccc1)C(=O)c1ccccc1)cccc4

STK552037
Synonyms: (4aS,4bR,7aS,8R)- 6- (4- bromophenyl)- 8- [(3- nitrophenyl)carbonyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: Brc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=CC=N1)C(=O)c1cccc(c1)[N+](=O)[O-]

STK552038
Synonyms: (4aS,4bR,7aS,8R)- 8- [(3- nitrophenyl)carbonyl]- 6- phenyl- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: O=C1N(c2ccccc2)C(=O)[C@@H]2[C@H]1[C@@H](N1[C@H]2C=CC=N1)C(=O)c1cccc(c1)[N+](=O)[O-]

STK552040
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 3- (4- methoxyphenyl)- 6,6- dimethyl- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2)Cl)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552041
Synonyms: [(1R,2S,3R)- 2- (4- bromophenyl)- 1- nitro- 1,2,3,10b- tetrahydropyrrolo[2,1- a]phthalazin- 3- yl](4- methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@@H]([C@H]1c1ccc(cc1)Br)[N+](=O)[O-])cccc3

STK552042
Synonyms: 3- (2- hydroxyphenyl)- 2- [(E)- 2- (4- methylphenyl)ethenyl]quinazolin- 4(3H)- one
Smiles: Cc1ccc(cc1)/C=C/c1nc2ccccc2c(=O)n1c1ccccc1O

STK552044
Synonyms: 1- cyclohexyl- 3- hydroxy- 4- [4- (prop- 2- en- 1- yloxy)phenyl]- 4,8- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7(6H)- one
Smiles: C=CCOc1ccc(cc1)C1SCC(=O)Nc2c1c(O)nn2C1CCCCC1

STK552045
Synonyms: 4- (benzyloxy)- N- [(5Z)- 5- (4- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]benzamide
Smiles: Fc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)OCc1ccccc1

STK552046
Synonyms: 1- amino- N- (3- methoxyphenyl)- 5- (morpholin- 4- yl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxamide
Smiles: COc1cccc(c1)NC(=O)c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1

STK552047
Synonyms: N- (4- ethoxyphenyl)- 11- (3- methoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)OC)c(nn1c1ccccc1)C

STK552049
Synonyms: (9E)- 9- (4- chlorobenzylidene)- 3,5- bis(4- chlorophenyl)- 7- methyl- 6,7,8,9- tetrahydro- 5H- pyrido[4,3- d][1,3]thiazolo[3,2- a]pyrimidine
Smiles: Clc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Cl)/C(=C/c1ccc(cc1)Cl)/CN(C2)C

STK552050
Synonyms: 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl)sulfanyl]- N,N- diphenylpropanamide
Smiles: CCn1c(SC(C(=O)N(c2ccccc2)c2ccccc2)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552051
Synonyms: propan- 2- yl2- amino- 1- [3- (trifluoromethyl)phenyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)C(F)(F)F)C

STK552055
Synonyms: (2'R,3'R)- N- (4- chlorophenyl)- 2'- (4- methoxyphenyl)- 1,3- dioxo- 1,2',3,3'- tetrahydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 3'- carboxamide
Smiles: COc1ccc(cc1)[C@H]1[C@H](C(=O)Nc2ccc(cc2)Cl)N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2

STK552057
Synonyms: ethyl5- methoxy- 3- {[3- (4- phenylpiperazin- 1- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1)cc(cc2)OC

STK552058
Synonyms: 10- [3- (trifluoromethyl)phenyl]pyrimido[4,5- b]quinoline- 2,4(3H,10H)- dione
Smiles: O=c1[nH]c(=O)c2c(n1)n(c1cccc(c1)C(F)(F)F)c1c(c2)cccc1

STK552059
Synonyms: ethyl4- {6- iodo- 2- [(E)- 2- (4- nitrophenyl)ethenyl]- 4- oxoquinazolin- 3(4H)- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(/C=C/c2ccc(cc2)[N+](=O)[O-])nc2c(c1=O)cc(cc2)I

STK552060
Synonyms: 1- (2- hydroxyethyl)- 2- imino- 3- [(4- methylphenyl)sulfonyl]- 1,2- dihydro- 5H- dipyrido[1,2- a:2',3'- d]pyrimidin- 5- one
Smiles: OCCn1c2nc3ccccn3c(=O)c2cc(c1=N)S(=O)(=O)c1ccc(cc1)C

STK552063
Synonyms: phenyl(2- thioxo[1,2,4]triazolo[5,1- b][1,3]benzothiazol- 1(2H)- yl)methanone
Smiles: S=c1nc2n(n1C(=O)c1ccccc1)c1c(s2)cccc1

STK552065
Synonyms: 2- {[5- (ethylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}- N- (4- methylphenyl)acetamide
Smiles: CCSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)C)nn2)CCCC3

STK552066
Synonyms: N~2~- (butan- 2- yl)- N~4~- (4- methoxyphenyl)- 5- nitropyrimidine- 2,4,6- triamine
Smiles: CCC(Nc1nc(Nc2ccc(cc2)OC)c(c(n1)N)[N+](=O)[O-])C

STK552068
Synonyms: 2- amino- 1- (4- chloro- 3- nitrophenyl)- N- hexyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)[N+](=O)[O-])Cl

STK552069
Synonyms: N- [(2- methoxydibenzo[b,d]furan- 3- yl)carbamothioyl]- 4- propoxybenzamide
Smiles: CCCOc1ccc(cc1)C(=O)NC(=S)Nc1cc2oc3c(c2cc1OC)cccc3

STK552071
Synonyms: 2- (4- chlorophenyl)- 3- {2- [2- (naphthalen- 2- yloxy)ethoxy]ethyl}quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOCCOc1ccc2c(c1)cccc2

STK552072
Synonyms: (8R,8aS,11aR)- 10- (2,4- dimethylphenyl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1C)C)cccc3

STK552073
Synonyms: (6aR,6bS,9aR,10S)- 8- (2- chlorophenyl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: O=C([C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccccc1Cl)C=Cc1c2cccc1)Nc1ccc(cc1)[N+](=O)[O-]

STK552077
Synonyms: 2- {[5- (2- chlorophenyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}- N- (4- phenylbutan- 2- yl)acetamide
Smiles: CC(NC(=O)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1Cl)CCc1ccccc1

STK552078
Synonyms: 7- chloro- 4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CC(Cc1nc2sc3c(c2c2c1CCC2)ncnc3Cl)C

STK552079
Synonyms: 10- methyl- N,8- diphenyl- 11- (thiophen- 2- yl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1nn(c2c1C(c1cccs1)n1c(=N2)c(Nc2ccccc2)nc2c1cccc2)c1ccccc1

STK552080
Synonyms: (5Z)- 5- ({1- [3- (3,4- dimethylphenoxy)propyl]- 1H- indol- 3- yl}methylidene)- 1- (4- fluorophenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCCOc2ccc(c(c2)C)C)/C1=O

STK552081
Synonyms: 2- (3,4- dimethoxyphenyl)- 4- (3,5- dimethylpiperidin- 1- yl)- 7- ethoxy- 6- methoxyquinazoline
Smiles: CCOc1cc2nc(nc(c2cc1OC)N1CC(C)CC(C1)C)c1ccc(c(c1)OC)OC

STK552082
Synonyms: (2E)- N- (3- chlorophenyl)- 2- cyano- 2- [(5E)- 5- (2,4- dichlorobenzylidene)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]ethanamide
Smiles: N#C/C(=c/1\s/c(=C/c2ccc(cc2Cl)Cl)/c(=O)n1c1ccccc1)/C(=O)Nc1cccc(c1)Cl

STK552083
Synonyms: 5- ethyl- 5- methyl- 2- (methylsulfanyl)- 3- (2- phenylethyl)- 5,6- dihydrobenzo[h]quinazolin- 4(3H)- one
Smiles: CSc1nc2c3ccccc3CC(c2c(=O)n1CCc1ccccc1)(C)CC

STK552084
Synonyms: (5Z)- 5- {[1- (4- chlorobenzyl)- 1H- indol- 3- yl]methylidene}- 1- (3- chloro- 4- methoxyphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1Cl)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccc(cc2)Cl)/C1=O

STK552085
Synonyms: dimethyl2- [(3- {[(4- chlorophenyl)sulfonyl]amino}quinoxalin- 2- yl)amino]benzene- 1,4- dicarboxylate
Smiles: COC(=O)c1ccc(cc1Nc1nc2ccccc2nc1NS(=O)(=O)c1ccc(cc1)Cl)C(=O)OC

STK552087
Synonyms: 3- {2- [2- (2- bromophenoxy)ethoxy]ethyl}- 2- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOCCOc1ccccc1Br

STK552088
Synonyms: N'- (8- fluoro- 5H- pyrimido[5,4- b]indol- 4- yl)- N,N- dimethylpropane- 1,3- diamine
Smiles: CN(CCCNc1ncnc2c1[nH]c1c2cc(cc1)F)C

STK552091
Synonyms: (2'R,3'R)- 3'- (2,2- dimethylpropanoyl)- 2'- (4- methoxyphenyl)- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: COc1ccc(cc1)[C@H]1[C@@H](N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2)C(=O)C(C)(C)C

STK552094
Synonyms: N- benzyl- 1- (2- hydroxyethyl)- 2- imino- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: OCCn1c(=N)c(cc2c1nc1ccccn1c2=O)C(=O)NCc1ccccc1

STK552098
Synonyms: N- (1,3- benzodioxol- 5- yl)- 10- methyl- 8- phenyl- 11- (3,4,5- trimethoxyphenyl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1c(OC)cc(cc1OC)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc2c(c1)OCO2)c1ccccc1

STK552099
Synonyms: 3- (2- chlorophenyl)- 6- iodo- 2- {(E)- 2- [4- (propan- 2- yl)phenyl]ethenyl}quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(cc1)C(C)C)c1ccccc1Cl

STK552100
Synonyms: 3- benzyl- 2- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 5- ethyl- 5- methyl- 5,6- dihydrobenzo[h]quinazolin- 4(3H)- one
Smiles: CCC1(C)Cc2ccccc2c2c1c(=O)n(c(n2)SCC(=O)c1ccc(cc1)Br)Cc1ccccc1

STK552101
Synonyms: 2- (4- chlorophenyl)- 3- [6- (4- methoxyphenoxy)hexyl]quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)OCCCCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK552102
Synonyms: (5Z)- 5- ({1- [3- (4- tert- butylphenoxy)propyl]- 1H- indol- 3- yl}methylidene)- 1- (furan- 2- ylmethyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\c1cn(c2c1cccc2)CCCOc1ccc(cc1)C(C)(C)C)Cc1ccco1

STK552103
Synonyms: N- carbamoyl- 4- ({(E)- 2- cyano- 2- [4- (3- methoxyphenyl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzenesulfonamide
Smiles: N#C/C(=C\Nc1ccc(cc1)S(=O)(=O)NC(=O)N)/c1scc(n1)c1cccc(c1)OC

STK552104
Synonyms: 2- imino- 10- methyl- N- (4- methylbenzyl)- 5- oxo- 1- (prop- 2- en- 1- yl)- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: C=CCn1c(=N)c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCc1ccc(cc1)C

STK552108
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 3- (prop- 2- en- 1- yl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: C=CCn1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552109
Synonyms: 4- [(E)- {2- [4- (3- chloro- 4- methylphenyl)piperazin- 1- yl]- 4- oxo- 1,3- thiazol- 5(4H)- ylidene}methyl]phenylbenzenesulfonate
Smiles: O=C1N=C(S/C/1=C/c1ccc(cc1)OS(=O)(=O)c1ccccc1)N1CCN(CC1)c1ccc(c(c1)Cl)C

STK552110
Synonyms: (2Z)- [2- (4- methoxyphenyl)hydrazinylidene][4- (3- methoxyphenyl)- 1,3- thiazol- 2- yl]ethanenitrile
Smiles: COc1ccc(cc1)N/N=C(\c1scc(n1)c1cccc(c1)OC)/C#N

STK552111
Synonyms: 6- iodo- 3- (2- methyl- 5- nitrophenyl)- 2- [(E)- 2- (3- nitrophenyl)ethenyl]quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1cccc(c1)[N+](=O)[O-])c1cc(ccc1C)[N+](=O)[O-]

STK552112
Synonyms: (4bR,7aS,8R)- 6- (2- fluorophenyl)- 8- [(4- methoxyphenyl)carbonyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=CC=CC2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1F

STK552113
Synonyms: 4- (6- {[4- (diethylamino)phenyl]amino}- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl)benzene- 1,2- diol
Smiles: CCN(c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(c(c2)O)O)c(nn1c1ccccc1)C)CC

STK552114
Synonyms: 2- {[2- (methylsulfanyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl]sulfanyl}- 1- phenylethanone
Smiles: CSc1nc(SCC(=O)c2ccccc2)c2c(n1)sc1c2CCCC1

STK552115
Synonyms: 2- amino- N- [2- (3,4- dimethoxyphenyl)ethyl]- 1- (3,4,5- trimethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccc(cc1OC)CCNC(=O)c1c2nc3ccccc3nc2n(c1N)c1cc(OC)c(c(c1)OC)OC

STK552118
Synonyms: 2- (ethylsulfanyl)- 6- iodo- 3- (2- methylprop- 2- en- 1- yl)quinazolin- 4(3H)- one
Smiles: CCSc1nc2ccc(cc2c(=O)n1CC(=C)C)I

STK552120
Synonyms: 3- (2- chlorophenyl)- 2- (4- chlorophenyl)tetrahydro- 1H,5H- pyrazolo[1,2- a][1,2,4]triazol- 1- one
Smiles: Clc1ccc(cc1)N1C(=O)N2N(C1c1ccccc1Cl)CCC2

STK552121
Synonyms: N- cyclopentyl- 1- (furan- 2- ylmethyl)- 2- imino- 10- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: O=C(c1cc2c(n(c1=N)Cc1ccco1)nc1n(c2=O)cccc1C)NC1CCCC1

STK552123
Synonyms: N- (4- ethoxyphenyl)- 11- (4- ethylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)CC)C)c1ccccc1

STK552124
Synonyms: prop- 2- en- 1- yl2- amino- 1- (2- ethylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccccc1CC

STK552125
Synonyms: 1- amino- N- methyl- 5- (morpholin- 4- yl)- N- phenyl- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1)N(c1ccccc1)C

STK552127
Synonyms: 2- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 3- (2- phenylethyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CC(=C)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK552128
Synonyms: 2- (4- chlorophenyl)- 3- [5- (2,3,6- trimethylphenoxy)pentyl]quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1c(C)ccc(c1C)C

STK552129
Synonyms: N- (1,3- benzodioxol- 5- yl)- 11- (3,4- dimethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(cc1OC)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc2c(c1)OCO2)c1ccccc1

STK552130
Synonyms: 2- (4- ethylphenyl)- 9- (4- methylphenyl)tetrahydro- 5H- pyrazolo[1,2- a]pyrrolo[3,4- c]pyrazole- 1,3(2H,3aH)- dione
Smiles: CCc1ccc(cc1)N1C(=O)C2C(C1=O)N1N(C2c2ccc(cc2)C)CCC1

STK552132
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 4- [(4- chlorobenzyl)oxy]- 5- methoxyphenyl}methylidene]- 5- (3- nitrophenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2cccc(c2)[N+](=O)[O-])c2nonc2N)cc(c1OCc1ccc(cc1)Cl)Br

STK552134
Synonyms: (1'S,2'S,3R,3a'R)- 2'- [(3,4- dimethoxyphenyl)carbonyl]- 1'- (2,2- dimethylpropanoyl)- 1',2'- dihydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: COc1ccc(cc1OC)C(=O)[C@@H]1[C@H](N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C

STK552135
Synonyms: 2- [(2,6- dichlorobenzyl)sulfanyl]- 6,6- dimethyl- 3- (4- methylphenyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Cc1ccc(cc1)n1c(SCc2c(Cl)cccc2Cl)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552136
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 11- (4- ethylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccc(c(c1)Cl)OC)nc1c2cccc1

STK552137
Synonyms: methyl5- (4- methylphenyl)- 4,6- dioxo- 1- (3- oxobutyl)- 1,3a,4,5,6,6a- hexahydropyrrolo[3,4- c]pyrazole- 3- carboxylate
Smiles: COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(cc1)C)CCC(=O)C

STK552138
Synonyms: 5- (methylsulfanyl)- 6,7,8,9- tetrahydro[1]benzothieno[3,2- e]tetrazolo[1,5- a]pyrimidine
Smiles: CSc1nc2nnnn2c2c1c1CCCCc1s2

STK552139
Synonyms: 4,4'- sulfanediylbis(6- bromo- 2- methylquinoline)
Smiles: Cc1cc(Sc2cc(C)nc3c2cc(Br)cc3)c2c(n1)ccc(c2)Br

STK552144
Synonyms: 2- {[10,10- dimethyl- 5- (methylsulfanyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}- 1- (4- fluorophenyl)ethanone
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)c1ccc(cc1)F)nn2)CC(OC3)(C)C

STK552149
Synonyms: 2- [(4- methylbenzyl)sulfanyl]- 3- (2- phenylethyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: Cc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK552150
Synonyms: 4- [5- (4- bromophenyl)- 3'- (4- methoxyphenyl)- 1'- phenyl- 4,5- dihydro- 1H,1'H- 3,4'- bipyrazol- 1- yl]- 4- oxobutanoicacid
Smiles: COc1ccc(cc1)c1nn(cc1C1=NN(C(C1)c1ccc(cc1)Br)C(=O)CCC(=O)O)c1ccccc1

STK552151
Synonyms: N- benzyl- 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3)NCc1ccccc1

STK552152
Synonyms: 3- [(4- bromobenzyl)sulfanyl]- 5- (methylsulfanyl)- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1ccc(cc1)Br)nn2)CCC3

STK552153
Synonyms: 1- (1- benzyl- 5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- [4- (4- fluorophenyl)piperazin- 1- yl]ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1ccc(cc1)F)c(n2Cc1ccccc1)C

STK552154
Synonyms: 3- (furan- 2- yl)- 1- (methylsulfonyl)- 5- phenyl- 4,5- dihydro- 1H- pyrazole
Smiles: CS(=O)(=O)N1N=C(CC1c1ccccc1)c1ccco1

STK552155
Synonyms: N~2~- [3- (dimethylamino)propyl]- N~4~- (4- methoxyphenyl)- 5- nitropyrimidine- 2,4,6- triamine
Smiles: COc1ccc(cc1)Nc1nc(NCCCN(C)C)nc(c1[N+](=O)[O-])N

STK552156
Synonyms: (2Z)- [2- (4- ethylphenyl)hydrazinylidene][4- (3- methoxyphenyl)- 1,3- thiazol- 2- yl]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)CC)/c1scc(n1)c1cccc(c1)OC

STK552157
Synonyms: 11- (4- tert- butylphenyl)- 10- methyl- 8- phenyl- N- [3- (trifluoromethyl)phenyl]- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1nn(c2c1C(c1ccc(cc1)C(C)(C)C)n1c(=N2)c(Nc2cccc(c2)C(F)(F)F)nc2c1cccc2)c1ccccc1

STK552158
Synonyms: (1'R,2'R,3a'S)- 1'- (2,2- dimethylpropanoyl)- 2'- (4- nitrophenyl)- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: [O-][N+](=O)c1ccc(cc1)[C@H]1[C@@H](N2[C@H]([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C

STK552161
Synonyms: 2- [(4- amino- 6- propyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- 1- (4- chlorophenyl)ethanone
Smiles: CCCC1OCc2c(C1)c1c(N)nc(nc1s2)SCC(=O)c1ccc(cc1)Cl

STK552162
Synonyms: methyl1- acetyl- 7- (4- methoxyphenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: COc1ccc(cc1)N1C(=O)CC2(C1=O)CC(=NN2C(=O)C)C(=O)OC

STK552164
Synonyms: N- (3- methoxyphenyl)- 2- {[3- (4- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)OC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552165
Synonyms: 3- (4- bromophenyl)- 7- (4- methylphenyl)- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: Cc1ccc(cc1)N1C(=O)CC2(C1=O)ON=C(C2)c1ccc(cc1)Br

STK552167
Synonyms: N- [2- hydroxy- 3- (piperidin- 1- yl)propyl]- N- (4- nitrophenyl)benzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccccc1)c1ccc(cc1)[N+](=O)[O-])CN1CCCCC1

STK552168
Synonyms: methyl5- (4- bromophenyl)- 1- (2- methylphenyl)- 4,6- dioxo- 1,3a,4,5,6,6a- hexahydropyrrolo[3,4- c]pyrazole- 3- carboxylate
Smiles: COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(cc1)Br)c1ccccc1C

STK552169
Synonyms: 4- (4- benzylpiperazin- 1- yl)- 2- (3,4- dimethoxyphenyl)- 7- ethoxy- 6- methoxyquinazoline
Smiles: CCOc1cc2nc(nc(c2cc1OC)N1CCN(CC1)Cc1ccccc1)c1ccc(c(c1)OC)OC

STK552170
Synonyms: N- (4- chlorophenyl)- 4- [4- (morpholin- 4- yl)- 3- nitrophenyl]phthalazin- 1- amine
Smiles: Clc1ccc(cc1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1

STK552171
Synonyms: (2Z)- 2- {(5E)- 5- [(1- benzyl- 1H- indol- 3- yl)methylidene]- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene}- N- (3- chlorophenyl)- 2- cyanoethanamide
Smiles: N#C/C(=c\1/s/c(=C/c2cn(c3c2cccc3)Cc2ccccc2)/c(=O)n1c1ccccc1)/C(=O)Nc1cccc(c1)Cl

STK552172
Synonyms: (2R,3R)- 3- [(4- methoxyphenyl)carbonyl]- 2- phenyl- 2,3- dihydropyrrolo[2,1- a]phthalazine- 1,1(10bH)- dicarbonitrile
Smiles: N#CC1(C#N)[C@@H](c2ccccc2)[C@@H](N2C1c1ccccc1C=N2)C(=O)c1ccc(cc1)OC

STK552174
Synonyms: 3- benzyl- 2- [(4- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: Cc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCC3

STK552175
Synonyms: 3- [6- (2- bromo- 4,6- dimethylphenoxy)hexyl]- 2- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCCOc1c(C)cc(cc1Br)C

STK552176
Synonyms: 2- (2- fluorophenyl)- 4- {(2Z)- 2- [1- (4- fluorophenyl)ethylidene]hydrazinyl}quinazoline
Smiles: Fc1ccc(cc1)/C(=N\Nc1nc(nc2c1cccc2)c1ccccc1F)/C

STK552177
Synonyms: 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N- (2- methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK552178
Synonyms: N- (3,5- dimethylphenyl)- 11- (furan- 2- yl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1cc(cc(c1)C)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccco2)c(nn1c1ccccc1)C

STK552179
Synonyms: 4- {6- [(3- chloro- 4- methylphenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}- 2- ethoxyphenol
Smiles: CCOc1cc(ccc1O)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)C)c1ccccc1

STK552180
Synonyms: (5Z)- 1- (3- chloro- 4- methoxyphenyl)- 5- {[1- (4- methylbenzyl)- 1H- indol- 3- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1Cl)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccc(cc2)C)/C1=O

STK552181
Synonyms: 4- (benzyloxy)- N- [(5Z)- 5- (1H- indol- 3- ylmethylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]benzamide
Smiles: O=C(c1ccc(cc1)OCc1ccccc1)NN1C(=S)S/C(=C\c2c[nH]c3c2cccc3)/C1=O

STK552182
Synonyms: 4- fluoro- N- {[2- (pyridin- 3- yl)piperidin- 1- yl]carbonothioyl}benzamide
Smiles: Fc1ccc(cc1)C(=O)NC(=S)N1CCCCC1c1cccnc1

STK552183
Synonyms: N- (2- fluorophenyl)- 2- [4- (propan- 2- yloxy)phenyl]quinazolin- 4- amine
Smiles: CC(Oc1ccc(cc1)c1nc(Nc2ccccc2F)c2c(n1)cccc2)C

STK552184
Synonyms: 7- (4- methoxyphenyl)- 1,3- dimethyl- 8- (tricyclo[3.3.1.1~3,7~]dec- 1- ylmethyl)- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COc1ccc(cc1)c1cn2c(n1CC13CC4CC(C3)CC(C1)C4)nc1c2c(=O)n(C)c(=O)n1C

STK552185
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(1E)- 1- (2,4- dichlorophenyl)ethylidene]- 5- (3- nitrophenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Clc1ccc(c(c1)Cl)/C(=N/NC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)/C

STK552186
Synonyms: ethyl3- {[3- (2,6- dimethylmorpholin- 4- yl)propanoyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CC(C)OC(C1)C)cc(cc2)OC

STK552187
Synonyms: (4Z)- 4- (3- bromo- 4- nitrobenzylidene)- 2- phenyl- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C\c1ccc(c(c1)Br)[N+](=O)[O-])c1ccccc1

STK552188
Synonyms: 3- ethyl- 2- [(3- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCn1c(SCc2cccc(c2)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552189
Synonyms: N- (2- chlorophenyl)- 7- (4- methylpiperidin- 1- yl)- 4- nitro- 2,1,3- benzoxadiazol- 5- amine
Smiles: CC1CCN(CC1)c1cc(Nc2ccccc2Cl)c(c2c1non2)[N+](=O)[O-]

STK552190
Synonyms: 2- {[4- oxo- 3- (prop- 2- en- 1- yl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: C=CCn1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552191
Synonyms: (6aS,6bR,9aS,10R)- N- (4- nitrophenyl)- 7,9- dioxo- 8- phenyl- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: O=C([C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccccc1)C=Cc1c2cccc1)Nc1ccc(cc1)[N+](=O)[O-]

STK552192
Synonyms: ethyl4- {6- iodo- 2- [(E)- 2- (4- methoxyphenyl)ethenyl]- 4- oxoquinazolin- 3(4H)- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(/C=C/c2ccc(cc2)OC)nc2c(c1=O)cc(cc2)I

STK552193
Synonyms: 3- (4- chlorophenyl)- 2- [(Z)- (1- methyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)methyl]quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)n1c(/C=C\2/c3ccccc3N(C2=O)C)nc2c(c1=O)cccc2

STK552194
Synonyms: 2- amino- 1- (2,4- dimethoxyphenyl)- N- hexyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1OC)OC

STK552195
Synonyms: 2- [(3- methylbenzyl)sulfanyl]- 3- (2- methylprop- 2- en- 1- yl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: Cc1cccc(c1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3

STK552196
Synonyms: 3- [2- (4- ethylphenyl)- 5,6- diphenyl- 1H- imidazo[1,2- a]imidazol- 1- yl]propan- 1- ol
Smiles: OCCCn1c(cn2c1nc(c2c1ccccc1)c1ccccc1)c1ccc(cc1)CC

STK552198
Synonyms: N- benzyl- 2- (4- benzylpiperazin- 1- yl)quinazolin- 4- amine
Smiles: c1ccc(cc1)CNc1nc(nc2c1cccc2)N1CCN(CC1)Cc1ccccc1

STK552199
Synonyms: (2E)- 3- {[2- (difluoromethoxy)phenyl]amino}- 2- [4- (4- ethylphenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC(F)F)/c1scc(n1)c1ccc(cc1)CC

STK552200
Synonyms: 2- amino- N- [2- (cyclohex- 1- en- 1- yl)ethyl]- 1- hexyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCC1=CCCCC1

STK552202
Synonyms: N- (4- {[7- (4- methylpiperidin- 1- yl)- 4- nitro- 2,1,3- benzoxadiazol- 5- yl]amino}phenyl)acetamide
Smiles: CC1CCN(CC1)c1cc(Nc2ccc(cc2)NC(=O)C)c(c2c1non2)[N+](=O)[O-]

STK552203
Synonyms: 2- methyl- 4- {4- [(4- methylphenyl)amino]- 3- nitrophenyl}phthalazin- 1(2H)- one
Smiles: Cc1ccc(cc1)Nc1ccc(cc1[N+](=O)[O-])c1nn(C)c(=O)c2c1cccc2

STK552204
Synonyms: (5Z)- 5- ({1- [3- (2- chlorophenoxy)propyl]- 1H- indol- 3- yl}methylidene)- 1- (4- ethylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCCOc2ccccc2Cl)/C1=O

STK552206
Synonyms: 1- [(4- tert- butylbenzyl)oxy]- 3- (naphthalen- 2- yl)quinoxalin- 2(1H)- one4- oxide
Smiles: O=c1n(OCc2ccc(cc2)C(C)(C)C)c2ccccc2[n+](c1c1ccc2c(c1)cccc2)[O-]

STK552207
Synonyms: 2- [(8,8- dimethyl- 5- phenyl- 7,10- dihydro- 8H- pyrano[3,4- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]- N- phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nnc2n1c(nc1c2COC(C1)(C)C)c1ccccc1

STK552208
Synonyms: 2- amino- 1- (2,5- dimethoxyphenyl)- N- [2- (3,4- dimethoxyphenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccc(c(c1)n1c2nc3ccccc3nc2c(c1N)C(=O)NCCc1ccc(c(c1)OC)OC)OC

STK552210
Synonyms: 8- bromo- 4- (3,4- dihydroisoquinolin- 2(1H)- yl)- 5H- pyrimido[5,4- b]indole
Smiles: Brc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCc2c(C1)cccc2

STK552211
Synonyms: (6aS,6bR,9aS,10R)- 8- (4- acetylphenyl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: O=C([C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)C(=O)C)C=Cc1c2cccc1)Nc1ccc(cc1)[N+](=O)[O-]

STK552212
Synonyms: (2E)- 3- {[2- (difluoromethoxy)phenyl]amino}- 2- [4- (4- fluorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC(F)F)/c1scc(n1)c1ccc(cc1)F

STK552213
Synonyms: (6aR,6bS,9aR,10S)- N- (4- nitrophenyl)- 7,9- dioxo- 8- [2- (trifluoromethyl)phenyl]- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: O=C([C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccccc1C(F)(F)F)C=Cc1c2cccc1)Nc1ccc(cc1)[N+](=O)[O-]

STK552215
Synonyms: (8R,8aS,11aR)- 10- (3- bromophenyl)- 8- [(4- chlorophenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)Br)cccc3

STK552216
Synonyms: (2E)- N- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 3- (furan- 2- yl)prop- 2- enamide
Smiles: O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)/C=C/c1ccco1

STK552217
Synonyms: N- (3- methylphenyl)- 4- [4- (morpholin- 4- yl)- 3- nitrophenyl]phthalazin- 1- amine
Smiles: Cc1cccc(c1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1

STK552218
Synonyms: ethyl4- (3- hexyl- 4- oxo- 3,4- dihydro- 11H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 11- yl)benzoate
Smiles: CCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)C(=O)OCC

STK552220
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(4- methylpiperidin- 1- yl)methyl]- N'- [(1E)- 1- (3- nitrophenyl)ethylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CC1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1cccc(c1)[N+](=O)[O-])\C

STK552221
Synonyms: 2- methoxyethyl2- amino- 1- (4- methylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)C

STK552222
Synonyms: 1- (4- methylphenyl)- 1H- tetrazol- 5- yl(1E)- N- (3- chloro- 2- methylphenyl)- 2- oxopropanehydrazonothioate
Smiles: Cc1ccc(cc1)n1nnnc1S/C(=N/Nc1cccc(c1C)Cl)/C(=O)C

STK552223
Synonyms: N- [4- (acetylamino)phenyl]- 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl)sulfanyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)NC(=O)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552224
Synonyms: (2Z)- 2- [(5E)- 5- (4- chlorobenzylidene)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]- 2- cyano- N- (3,4- dichlorophenyl)ethanamide
Smiles: N#C/C(=c\1/s/c(=C/c2ccc(cc2)Cl)/c(=O)n1c1ccccc1)/C(=O)Nc1ccc(c(c1)Cl)Cl

STK552226
Synonyms: 2- {[6- iodo- 3- (3- methylphenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)SCC(=O)N(c1ccccc1)c1ccccc1)c1cccc(c1)C

STK552228
Synonyms: (2Z)- [2- (4- fluorophenyl)hydrazinylidene][4- (3- methoxyphenyl)- 1,3- thiazol- 2- yl]ethanenitrile
Smiles: COc1cccc(c1)c1csc(n1)/C(=N\Nc1ccc(cc1)F)/C#N

STK552229
Synonyms: 11- (2- methoxyphenyl)- 10- methyl- N- (3- methylphenyl)- 8- (pyridin- 2- yl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cccc(c1)C)c1ccccn1

STK552230
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (5- bromo- 2- hydroxyphenyl)methylidene]- 5- (3- nitrophenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Brc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)O

STK552231
Synonyms: 1- amino- N- (diphenylmethyl)- 5- (morpholin- 4- yl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1)NC(c1ccccc1)c1ccccc1

STK552232
Synonyms: 3- [(2,4- dichlorobenzyl)sulfanyl]- 5- (methylsulfanyl)- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1ccc(cc1Cl)Cl)nn2)CCC3

STK552233
Synonyms: (4E)- 4- {[4- (dimethylamino)phenyl]imino}- 5- hydroxy- 2- (thiomorpholin- 4- yl)naphthalen- 1(4H)- one
Smiles: CN(c1ccc(cc1)/N=C/1\C=C(N2CCSCC2)C(=O)c2c1c(O)ccc2)C

STK552234
Synonyms: 10- butyl- 7,8,9,11a- tetrahydro- 6bH- cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncn1c3nnc1

STK552237
Synonyms: 12- hexyl- 9- (hexylsulfanyl)- 6,6- dimethyl- 6,12- dihydrobenzo[h][1,2,4]triazolo[3,4- b]quinazolin- 7(5H)- one
Smiles: CCCCCCSc1nnc2n1c(=O)c1c(n2CCCCCC)c2ccccc2CC1(C)C

STK552241
Synonyms: 12- butyl- 9- (butylsulfanyl)- 5H- spiro[benzo[h][1,2,4]triazolo[3,4- b]quinazoline- 6,1'- cyclopentan]- 7(12H)- one
Smiles: CCCCn1c2c3ccccc3CC3(c2c(=O)n2c1nnc2SCCCC)CCCC3

STK552242
Synonyms: ethyl[(5- ethyl- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1nnc2n1c(CC)nc1c2c2CC(C)(C)OCc2s1

STK552243
Synonyms: 2,2- dichloro- 1- phenyl- N- (propan- 2- yl)cyclopropanecarboxamide
Smiles: CC(NC(=O)C1(CC1(Cl)Cl)c1ccccc1)C

STK552244
Synonyms: 4- butyl- 7- [(2- chlorobenzyl)sulfanyl]- 2,3,5a,10b- tetrahydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncnc3SCc1ccccc1Cl

STK552245
Synonyms: (5Z)- 1- (3- chloro- 4- methylphenyl)- 5- ({1- [3- (2- methylphenoxy)propyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\c1cn(c2c1cccc2)CCCOc1ccccc1C)c1ccc(c(c1)Cl)C

STK552246
Synonyms: ethyl1- (2- chlorophenyl)- 5- (2- methoxyphenyl)- 4,6- dioxo- 1,3a,4,5,6,6a- hexahydropyrrolo[3,4- c]pyrazole- 3- carboxylate
Smiles: CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccccc1OC)c1ccccc1Cl

STK552247
Synonyms: 1- [(3,4- dimethoxybenzyl)oxy]- 3- phenylquinoxalin- 2(1H)- one4- oxide
Smiles: COc1cc(ccc1OC)COn1c2ccccc2[n+](c(c1=O)c1ccccc1)[O-]

STK552250
Synonyms: N- (4- chlorophenyl)- 2- [(5- hydrazinyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetamide
Smiles: NNc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)Cl)nn2)CCCC3

STK552252
Synonyms: N- (4- methylphenyl)- 2- {[4- oxo- 3- (prop- 2- en- 1- yl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552253
Synonyms: 6- iodo- 3- (naphthalen- 2- yl)- 2- [(E)- 2- (4- nitrophenyl)ethenyl]quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(cc1)[N+](=O)[O-])c1ccc2c(c1)cccc2

STK552254
Synonyms: 2- {[5- (methylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}- N- (1- phenylpropan- 2- yl)acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)NC(Cc1ccccc1)C)nn2)CCCC3

STK552255
Synonyms: ethyl5- bromo- 3- ethyl- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1CC)cc(cc2)Br

STK552257
Synonyms: N~4~- (4- chlorophenyl)- N~2~- (furan- 2- ylmethyl)- 5- nitropyrimidine- 2,4,6- triamine
Smiles: Clc1ccc(cc1)Nc1nc(NCc2ccco2)nc(c1[N+](=O)[O-])N

STK552258
Synonyms: prop- 2- en- 1- yl1- (3- acetylphenyl)- 2- amino- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)C(=O)C

STK552259
Synonyms: 2- {[2- (4- fluorophenyl)- 2- oxoethyl]sulfanyl}- 3- (4- methoxyphenyl)- 6,6- dimethyl- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)F)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552261
Synonyms: 4- {[(6aS,6bR,9aS,10R)- 8- (4- chlorophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinolin- 10- yl]carbonyl}phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)Cl)C=Cc1c2cccc1

STK552262
Synonyms: 2- amino- 1- (4- butylphenyl)- N- (2,5- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)Nc1cc(C)ccc1C

STK552263
Synonyms: 8- cyclohexylidene- 2- (4- ethoxyphenyl)- 3a,4,7,7a- tetrahydro- 1H- 4,7- methanoisoindole- 1,3(2H)- dione
Smiles: CCOc1ccc(cc1)N1C(=O)C2C(C1=O)C1C(=C3CCCCC3)C2C=C1

STK552265
Synonyms: 11- (2- methoxybenzyl)- 3- (2- methoxyphenyl)- 2- methyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccccc1Cn1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)c1ccccc1OC

STK552266
Synonyms: 9- (furan- 2- ylmethyl)- 5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8(9H)- one
Smiles: O=c1n(cnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1)Cc1ccco1

STK552267
Synonyms: 2- [(E)- 2- (1- benzyl- 1H- indol- 3- yl)ethenyl]- 3- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)n1c(/C=C/c2cn(c3c2cccc3)Cc2ccccc2)nc2c(c1=O)cccc2

STK552269
Synonyms: N- (4- methoxyphenyl)- 2- (4- methylpiperazin- 1- yl)- 5- nitropyrimidine- 4,6- diamine
Smiles: COc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N1CCN(CC1)C

STK552270
Synonyms: N- (2,5- dimethylphenyl)- N- [(2- hydroxy- 7- methylquinolin- 3- yl)methyl]- 2- methoxybenzamide
Smiles: COc1ccccc1C(=O)N(c1cc(C)ccc1C)Cc1cc2ccc(cc2nc1O)C

STK552271
Synonyms: (5E)- 5- [4- (dimethylamino)benzylidene]- 1- (2,4- dimethylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1ccc(c(c1)C)N1C(=O)NC(=O)/C(=C\c2ccc(cc2)N(C)C)/C1=O

STK552272
Synonyms: ethyl3- [(E)- (4- carbamoylpiperidin- 1- yl)diazenyl]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCC(CC1)C(=O)N)cccc2

STK552273
Synonyms: (5E)- 1- (2,5- dimethylphenyl)- 5- (1H- indol- 3- ylmethylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1ccc(c(c1)N1C(=O)NC(=O)/C(=C\c2c[nH]c3c2cccc3)/C1=O)C

STK552274
Synonyms: 4- [(6aR,6bS,9aR,10S)- 10- [(4- nitrophenyl)carbamoyl]- 7,9- dioxo- 6b,7,9a,10- tetrahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinolin- 8(9H)- yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK552276
Synonyms: ethyl3- [2- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)ethyl]- 5- phenoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1CCN1C(=O)c3c(C1=O)cccc3)cc(cc2)Oc1ccccc1

STK552277
Synonyms: 6- chloro- 3- methyl- 10- (4- methylphenyl)pyrimido[4,5- b]quinoline- 2,4(3H,10H)- dione
Smiles: Cc1ccc(cc1)n1c2cccc(c2cc2c1nc(=O)n(c2=O)C)Cl

STK552278
Synonyms: (9E)- 3- (4- chlorophenyl)- 9- (4- methoxybenzylidene)- 5- (4- methoxyphenyl)- 7- methyl- 6,7,8,9- tetrahydro- 5H- pyrido[4,3- d][1,3]thiazolo[3,2- a]pyrimidine
Smiles: COc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Cl)/C(=C/c1ccc(cc1)OC)/CN(C2)C

STK552280
Synonyms: N- (4- {[7- (dimethylamino)- 4- nitro- 2,1,3- benzoxadiazol- 5- yl]amino}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)Nc1cc(N(C)C)c2c(c1[N+](=O)[O-])non2

STK552281
Synonyms: (4aS,4bR,7aS,8R)- 6- (2- fluorophenyl)- 8- [(3- nitrophenyl)carbonyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: O=C1[C@H]2[C@@H](C(=O)N1c1ccccc1F)[C@H]1N([C@H]2C(=O)c2cccc(c2)[N+](=O)[O-])N=CC=C1

STK552282
Synonyms: N~4~- benzyl- N~2~- (butan- 2- yl)- 5- nitropyrimidine- 2,4,6- triamine
Smiles: CCC(Nc1nc(NCc2ccccc2)c(c(n1)N)[N+](=O)[O-])C

STK552283
Synonyms: (4bR,7aS,8R)- 8- [(4- methoxyphenyl)carbonyl]- 6- (4- methylphenyl)- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=CC=CC2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)C

STK552284
Synonyms: 6- ethyl- 2- [(3- fluorobenzyl)sulfanyl]- 6- methyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CCC1(C)OCc2c(C1)c1c(N)nc(nc1s2)SCc1cccc(c1)F

STK552288
Synonyms: (2'R,3'R)- 2'- (4- methoxyphenyl)- 3'- [(4- methoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1ccc(cc1)OC)C(=O)c1c(C2=O)cccc1)cccc3

STK552289
Synonyms: (1'S,2'S,3R,3a'R)- 1'- [(4- chlorophenyl)carbonyl]- 2'- (phenylcarbonyl)- 1',2'- dihydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2c3ccccc3C=C[C@@H]2[C@]2([C@@H]1C(=O)c1ccccc1)C(=O)Nc1c2cccc1

STK552290
Synonyms: (2E)- 3- (4- chlorophenyl)- N- {[2- (pyridin- 3- yl)piperidin- 1- yl]carbamothioyl}prop- 2- enamide
Smiles: S=C(NN1CCCCC1c1cccnc1)NC(=O)/C=C/c1ccc(cc1)Cl

STK552292
Synonyms: 3- [(3- amino- 2,4,6- trinitrophenyl)amino]phenol
Smiles: Oc1cccc(c1)Nc1c(cc(c(c1[N+](=O)[O-])N)[N+](=O)[O-])[N+](=O)[O-]

STK552293
Synonyms: (8R,8aS,11aR)- 8- (2,2- dimethylpropanoyl)- 10- (3- fluorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: Fc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)C1N([C@H]2C(=O)C(C)(C)C)N=Cc2c1cccc2

STK552295
Synonyms: 11- (4- fluorobenzyl)- 2- methyl- 3- (1- phenylethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Fc1ccc(cc1)Cn1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)C(c1ccccc1)C

STK552297
Synonyms: (2Z)- 2- cyano- 2- [(5Z)- 5- {[5- (4- fluorophenyl)furan- 2- yl]methylidene}- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]- N- (furan- 2- ylmethyl)ethanamide
Smiles: N#C/C(=c\1/s/c(=C\c2ccc(o2)c2ccc(cc2)F)/c(=O)n1c1ccccc1)/C(=O)NCc1ccco1

STK552299
Synonyms: ethyl3- {[3- (3,5- dimethylpiperidin- 1- yl)propanoyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CC(C)CC(C1)C)cc(cc2)OC

STK552300
Synonyms: 10- (2,4- dimethylphenyl)pyrimido[4,5- b]quinoline- 2,4(3H,10H)- dione
Smiles: Cc1ccc(c(c1)C)n1c2ccccc2cc2c1nc(=O)[nH]c2=O

STK552301
Synonyms: 4- (benzylsulfanyl)- 2- phenyl- 6- (propan- 2- yl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CC(C1OCc2c(C1)c1c(SCc3ccccc3)nc(nc1s2)c1ccccc1)C

STK552302
Synonyms: ethyl3- methyl- 5- phenoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1C)cc(cc2)Oc1ccccc1

STK552303
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(2,5- dimethoxyphenyl)carbonyl]- 3'- (2,2- dimethylpropanoyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1ccc(c(c1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C)OC

STK552304
Synonyms: ethyl(2Z)- 3,4- dihydroquinolin- 1(2H)- yl[2- (3- methoxyphenyl)hydrazinylidene]ethanoate
Smiles: CCOC(=O)/C(=N/Nc1cccc(c1)OC)/N1CCCc2c1cccc2

STK552305
Synonyms: 10,10- dimethyl- 5- (methylsulfanyl)- 3- [(2- phenylethyl)sulfanyl]- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCCc1ccccc1)nn2)CC(OC3)(C)C

STK552306
Synonyms: 2- {1- [4- (2- methylpropyl)phenyl]ethyl}- 1- (naphthalen- 1- ylmethyl)- 1H- benzimidazole
Smiles: CC(Cc1ccc(cc1)C(c1nc2c(n1Cc1cccc3c1cccc3)cccc2)C)C

STK552307
Synonyms: N- [3- (dimethylamino)- 2- hydroxypropyl]- 4- methyl- N- (3- nitrophenyl)benzenesulfonamide
Smiles: CN(CC(CN(S(=O)(=O)c1ccc(cc1)C)c1cccc(c1)[N+](=O)[O-])O)C

STK552308
Synonyms: 2- (4- chlorophenyl)- 3- [4- (2- nitrophenoxy)butyl]quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1ccccc1[N+](=O)[O-]

STK552309
Synonyms: 2- [(2Z)- 2- (3,5- diphenylcyclohex- 2- en- 1- ylidene)hydrazinyl]- 6- methyl- 4- phenylquinazoline
Smiles: Cc1ccc2c(c1)c(nc(n2)N/N=C\1/CC(CC(=C1)c1ccccc1)c1ccccc1)c1ccccc1

STK552310
Synonyms: ethyl1- {[(phenylcarbonyl)carbamothioyl]amino}- 5- (propan- 2- yl)- 7,8- dihydro- 6H- cyclopenta[d]thieno[2,3- b]pyridine- 2- carboxylate
Smiles: CCOC(=O)c1sc2c(c1NC(=S)NC(=O)c1ccccc1)c1CCCc1c(n2)C(C)C

STK552311
Synonyms: 4- [(E)- {2- [4- (4- chlorophenyl)piperazin- 1- yl]- 4- oxo- 1,3- thiazol- 5(4H)- ylidene}methyl]phenylbenzenesulfonate
Smiles: Clc1ccc(cc1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(cc2)OS(=O)(=O)c2ccccc2)/S1

STK552315
Synonyms: 3,3,6,6- tetramethyl- 9- (1- methyl- 1H- pyrazol- 4- yl)- 10- (pyridin- 2- yl)- 3,4,6,7,9,10- hexahydroacridine- 1,8(2H,5H)- dione
Smiles: Cn1ncc(c1)C1C2=C(CC(CC2=O)(C)C)N(C2=C1C(=O)CC(C2)(C)C)c1ccccn1

STK552316
Synonyms: N- (4- bromophenyl)- 11- (4- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Fc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1)Br)c1ccccc1

STK552317
Synonyms: (8S,8aR,11aS,11bS)- 8- (2,2- dimethylpropanoyl)- 10- (2- methyl- 4- nitrophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Cc1cc(ccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2c2ccccc2C=C1)C(=O)C(C)(C)C)[N+](=O)[O-]

STK552318
Synonyms: ethyl(2Z)- [(4,5- diphenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl][2- (3- methylphenyl)hydrazinylidene]ethanoate
Smiles: CCOC(=O)/C(=N/Nc1cccc(c1)C)/Sc1nnc(n1c1ccccc1)c1ccccc1

STK552319
Synonyms: 2- {[4- butyl- 9- (methylsulfanyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: CCCCc1nc2sc3c(c2c2c1CCC2)nc(nc3SCC(=O)N(c1ccccc1)c1ccccc1)SC

STK552320
Synonyms: (6aS,6bR,9aS,10R)- 8- (4- methylphenyl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK552321
Synonyms: 2- [(4- amino- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- (2- phenylethyl)acetamide
Smiles: O=C(CSc1nc(N)c2c(n1)sc1c2CC(OC1)(C)C)NCCc1ccccc1

STK552322
Synonyms: (5Z)- 5- ({1- [3- (3,5- dimethylphenoxy)propyl]- 1H- indol- 3- yl}methylidene)- 1- (4- fluorophenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCCOc2cc(C)cc(c2)C)/C1=O

STK552327
Synonyms: 2- (3- oxo- 3- phenylpropyl)cyclopentanone
Smiles: O=C1CCCC1CCC(=O)c1ccccc1

STK552328
Synonyms: 9'- bromo- 1- methyl- 2'- (pyridin- 3- yl)- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CN1CCC2(CC1)Oc1ccc(cc1C1N2N=C(C1)c1cccnc1)Br

STK552329
Synonyms: bis(2- methylpropyl)[(2,4- dichlorophenyl)(hydroxy)methyl]phosphonate
Smiles: CC(COP(=O)(C(c1ccc(cc1Cl)Cl)O)OCC(C)C)C

STK552330
Synonyms: 2- (2- {[10,10- dimethyl- 5- (methylsulfanyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}ethyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: CSc1nc2sc3c(c2c2n1c(SCCN1C(=O)c4c(C1=O)cccc4)nn2)CC(OC3)(C)C

STK552331
Synonyms: 10- (2- methylphenyl)pyrimido[4,5- b]quinoline- 2,4(3H,10H)- dione
Smiles: O=c1[nH]c(=O)c2c(n1)n(c1ccccc1C)c1c(c2)cccc1

STK552333
Synonyms: 6,6- dimethyl- 2- (methylsulfanyl)- 4- [(naphthalen- 2- ylmethyl)sulfanyl]- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CSc1nc(SCc2ccc3c(c2)cccc3)c2c(n1)sc1c2CC(OC1)(C)C

STK552334
Synonyms: (5Z)- 5- ({1- [2- (4- chlorophenoxy)ethyl]- 1H- indol- 3- yl}methylidene)- 1- (4- ethylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCOc2ccc(cc2)Cl)/C1=O

STK552335
Synonyms: 5- (2- chlorophenyl)- 3- (methylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1Cl

STK552336
Synonyms: 3- [4- (dimethylamino)phenyl]- 5- (naphthalen- 1- yl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: CN(c1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1cccc2c1cccc2)c1ccccc1)C

STK552337
Synonyms: 3- butyl- 2- [(2- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCn1c(SCc2ccccc2C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK552339
Synonyms: 2- (butylsulfanyl)- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCn1c(SCCCC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552341
Synonyms: N- [(5Z)- 5- (2,5- dimethoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- 4- fluorobenzamide
Smiles: COc1ccc(cc1/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)F)OC

STK552345
Synonyms: (4aS,4bR,7aS,8R)- 6- (naphthalen- 2- yl)- 8- [(3- nitrophenyl)carbonyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: O=C1N(c2ccc3c(c2)cccc3)C(=O)[C@@H]2[C@H]1[C@@H](N1[C@H]2C=CC=N1)C(=O)c1cccc(c1)[N+](=O)[O-]

STK552346
Synonyms: 12- (3- methylbutyl)- 9- [(3- methylbutyl)sulfanyl]- 5H- spiro[benzo[h][1,2,4]triazolo[3,4- b]quinazoline- 6,1'- cyclopentan]- 7(12H)- one
Smiles: CC(CCn1c2c3ccccc3CC3(c2c(=O)n2c1nnc2SCCC(C)C)CCCC3)C

STK552347
Synonyms: (9E)- 9- (4- fluorobenzylidene)- 5- (4- fluorophenyl)- 7- methyl- 3- (4- methylphenyl)- 6,7,8,9- tetrahydro- 5H- pyrido[4,3- d][1,3]thiazolo[3,2- a]pyrimidine
Smiles: CN1C/C(=C\c2ccc(cc2)F)/C2=C(C1)C(c1ccc(cc1)F)n1c(=N2)scc1c1ccc(cc1)C

STK552348
Synonyms: N'- {(E)- [4- (dimethylamino)phenyl]methylidene}- 2- oxopiperidine- 3- carbohydrazide
Smiles: CN(c1ccc(cc1)/C=N/NC(=O)C1CCCNC1=O)C

STK552350
Synonyms: N- methyl- 4- [(2,3,5,6- tetrafluoropyridin- 4- yl)oxy]aniline
Smiles: CNc1ccc(cc1)Oc1c(F)c(F)nc(c1F)F

STK552351
Synonyms: N- (3,4- dimethylphenyl)- 10- methyl- 8- phenyl- 11- (3,4,5- trimethoxyphenyl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1c(OC)cc(cc1OC)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)C)C)c1ccccc1

STK552353
Synonyms: N- (4- chlorophenyl)- 2- {[5- (methylsulfanyl)- 10- (propan- 2- yl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)Cl)nn2)CC(OC3)C(C)C

STK552354
Synonyms: 1,6- bis(4- butoxyphenyl)- 2,5- bis[(diethylamino)methyl]hexane- 1,6- dione
Smiles: CCN(CC(C(=O)c1ccc(cc1)OCCCC)CCC(C(=O)c1ccc(cc1)OCCCC)CN(CC)CC)CC

STK552355
Synonyms: N~4~- benzyl- N~2~- (3- methoxypropyl)- 5- nitropyrimidine- 2,4,6- triamine
Smiles: COCCCNc1nc(NCc2ccccc2)c(c(n1)N)[N+](=O)[O-]

STK552356
Synonyms: tert- butyl(2'R,3'R)- 2'- (3- nitrophenyl)- 1,3- dioxo- 1,2',3,3'- tetrahydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 3'- carboxylate
Smiles: O=C([C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1cccc(c1)[N+](=O)[O-])C(=O)c1c(C2=O)cccc1)cccc3)OC(C)(C)C

STK552358
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- cyclohexylmethylidene]- 5- (3- nitrophenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)N/N=C/C1CCCCC1

STK552360
Synonyms: 5- (4- chlorophenyl)- 3- (4- hydroxyphenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: Oc1ccc(cc1)C1C2C(=O)N(C(=O)C2ON1c1ccccc1)c1ccc(cc1)Cl

STK552361
Synonyms: 2- imino- 1- (2- methoxyethyl)- 8- methyl- 3- (phenylsulfonyl)- 1,2- dihydro- 5H- dipyrido[1,2- a:2',3'- d]pyrimidin- 5- one
Smiles: COCCn1c2nc3ccc(cn3c(=O)c2cc(c1=N)S(=O)(=O)c1ccccc1)C

STK552362
Synonyms: (8R,8aS,11aR)- 8- acetyl- 10- (4- chlorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: CC(=O)[C@H]1[C@H]2C(=O)N(C(=O)[C@H]2C2N1N=Cc1c2cccc1)c1ccc(cc1)Cl

STK552363
Synonyms: 6- hydroxy- 5- (7- hydroxy- 6- methyl- 1,3- dihydrofuro[3,4- c]pyridin- 1- yl)- 1,3- bis(2- methylphenyl)- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: Cc1ncc2c(c1O)C(OC2)c1c(O)n(c2ccccc2C)c(=S)n(c1=O)c1ccccc1C

STK552364
Synonyms: 2- {[3- (4- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N- phenylacetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552365
Synonyms: ethyl7- {[(3,5- dimethylpiperidin- 1- yl)acetyl]amino}- 5H- [1,3]dioxolo[4,5- f]indole- 6- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CC(C)CC(C1)C)cc1c(c2)OCO1

STK552366
Synonyms: 1- [5- (2- chlorophenyl)- 3- phenyl- 4,5- dihydro- 1H- pyrazol- 1- yl]ethanone
Smiles: CC(=O)N1N=C(CC1c1ccccc1Cl)c1ccccc1

STK552367
Synonyms: 3- (2- methoxyphenyl)- 2- [(2- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: COc1ccccc1n1c(SCc2ccccc2C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK552368
Synonyms: 1- (4- methylphenyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- amine
Smiles: Cc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccc(cc1)C

STK552370
Synonyms: (5Z)- 3- (3,5- dichlorophenyl)- 2- thioxo- 5- (3,4,5- trimethoxybenzylidene)- 1,3- thiazolidin- 4- one
Smiles: COc1cc(/C=C/2\SC(=S)N(C2=O)c2cc(Cl)cc(c2)Cl)cc(c1OC)OC

STK552371
Synonyms: N,1- dibenzyl- 2- imino- 10- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: Cc1cccn2c1nc1n(Cc3ccccc3)c(=N)c(cc1c2=O)C(=O)NCc1ccccc1

STK552372
Synonyms: N'- [(1E,2E)- 3- (furan- 2- yl)- 2- methylprop- 2- en- 1- ylidene]pyrazine- 2- carbohydrazide
Smiles: C/C(=C\c1ccco1)/C=N/NC(=O)c1cnccn1

STK552373
Synonyms: 1- benzyl- 2,5,6- triphenyl- 1H- imidazo[1,2- a]imidazole
Smiles: c1ccc(cc1)Cn1c(cn2c1nc(c2c1ccccc1)c1ccccc1)c1ccccc1

STK552375
Synonyms: N- (8- methyl- 2- phenylimidazo[1,2- a]pyridin- 3- yl)- 4- nitrobenzamide
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])Nc1c(nc2n1cccc2C)c1ccccc1

STK552376
Synonyms: N- [2- hydroxy- 6- methyl- 4- (propan- 2- yl)phenyl]thiophene- 2- carboxamide
Smiles: CC(c1cc(C)c(c(c1)O)NC(=O)c1cccs1)C

STK552377
Synonyms: 2- [(3- benzyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl)sulfanyl]- N- (4- bromophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCC3

STK552378
Synonyms: 8- bromo- N- [2- (cyclohex- 1- en- 1- yl)ethyl]- 5H- pyrimido[5,4- b]indol- 4- amine
Smiles: Brc1ccc2c(c1)c1ncnc(c1[nH]2)NCCC1=CCCCC1

STK552379
Synonyms: (4aS,4bR,7aS,8R)- 6- (2,4- dimethylphenyl)- 8- [(3- nitrophenyl)carbonyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=CC=N1)C(=O)c1cccc(c1)[N+](=O)[O-]

STK552380
Synonyms: N'- [(E)- (2,4,5- trimethoxyphenyl)methylidene]pyridine- 2- carbohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)c1ccccn1)OC

STK552381
Synonyms: N~6~- (2,5- dichlorophenyl)- N~4~,N~4~- diethyl- 7- nitro- 2,1,3- benzoxadiazole- 4,6- diamine
Smiles: CCN(c1cc(Nc2cc(Cl)ccc2Cl)c(c2c1non2)[N+](=O)[O-])CC

STK552383
Synonyms: 3- bromo- 2- oxo- N- (pyridin- 2- ylmethyl)- 2H- pyran- 5- carboxamide
Smiles: O=C(c1coc(=O)c(c1)Br)NCc1ccccn1

STK552384
Synonyms: 3- {2- [2- (2- bromo- 4- chlorophenoxy)ethoxy]ethyl}- 2- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOCCOc1ccc(cc1Br)Cl

STK552385
Synonyms: (5Z)- 5- {[1- (3,4- dichlorobenzyl)- 1H- indol- 3- yl]methylidene}- 1- (4- fluorophenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccc(c(c2)Cl)Cl)/C1=O

STK552386
Synonyms: 2- {[2- (4- butoxyphenyl)- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]sulfanyl}- 1- (4- fluorophenyl)ethanone
Smiles: CCCCOc1ccc(cc1)c1nc(SCC(=O)c2ccc(cc2)F)c2c(n1)sc1c2CC(OC1)(C)C

STK552387
Synonyms: ethyl5- methyl- 2- (propanoylamino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CC)sc2c1CC(C)CC2

STK552388
Synonyms: 1- [7- (3- bromophenyl)- 3b,6,6a,7,9,9a,10,12a- octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1- ij]quinolin- 2- yl]ethanone
Smiles: Brc1cccc(c1)C1C2CC=CC2c2c3N1CC1CC=CC1c3cc(c2)C(=O)C

STK552389
Synonyms: 8- [(2- chlorobenzyl)sulfanyl]- 10- (methylsulfanyl)- 5- (propan- 2- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: CSc1nc(SCc2ccccc2Cl)c2c(n1)c1c(s2)nc(c2c1CCCC2)C(C)C

STK552390
Synonyms: 3- methyl- 7- {[2- (3- methylpiperidin- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: CC1CCCN(C1)CCNc1cc2oc3cc(C)ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1

STK552392
Synonyms: (5Z)- 5- {[1- (2,6- dichlorobenzyl)- 1H- indol- 3- yl]methylidene}- 1- (4- fluorophenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2c(Cl)cccc2Cl)/C1=O

STK552393
Synonyms: 2- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 3- (2- phenylethyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: Brc1ccc(cc1)C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK552395
Synonyms: 9- (4- chlorophenyl)- 5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8(9H)- one
Smiles: Clc1ccc(cc1)n1cnc2c(c1=O)sc1c2c2CCCCc2c(n1)N1CCOCC1

STK552397
Synonyms: 5- (2- chlorophenyl)- 3- (3- nitrophenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: Clc1ccccc1N1C(=O)C2C(C1=O)ON(C2c1cccc(c1)[N+](=O)[O-])c1ccccc1

STK552398
Synonyms: (5E)- 1- (2,4- dimethylphenyl)- 5- (4- methoxy- 3- nitrobenzylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1[N+](=O)[O-])/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1C)C

STK552399
Synonyms: 2- (2- {[3- (3- methylphenyl)- 4- oxo- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}ethyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)c1cccc(c1)C)SCCN1C(=O)c2c(C1=O)cccc2)C

STK552400
Synonyms: 2- {(2Z)- 2- [(2E)- benzylidenehydrazinylidene]- 4- oxo- 1,3- thiazolidin- 5- yl}- N- (4- chlorophenyl)acetamide
Smiles: O=C(CC1S/C(=N\N=C\c2ccccc2)/NC1=O)Nc1ccc(cc1)Cl

STK552401
Synonyms: 2- [(6,6- dimethyl- 4- oxo- 3- phenyl- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- (1- phenylpropan- 2- yl)acetamide
Smiles: CC(Cc1ccccc1)NC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(OC3)(C)C

STK552402
Synonyms: [2- (4- methylphenyl)- 1,3- thiazolidin- 3- yl](4- nitrophenyl)methanone
Smiles: Cc1ccc(cc1)C1SCCN1C(=O)c1ccc(cc1)[N+](=O)[O-]

STK552404
Synonyms: N- [(2- hydroxy- 7- methylquinolin- 3- yl)methyl]- 2- methyl- N- (2- methylphenyl)benzamide
Smiles: Cc1ccc2c(c1)nc(c(c2)CN(c1ccccc1C)C(=O)c1ccccc1C)O

STK552405
Synonyms: (2E)- 2- cyano- N- (2,3- dimethylphenyl)- 2- [5- (3- methylbenzyl)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]ethanamide
Smiles: N#C/C(=C/1\SC(C(=O)N1c1ccccc1)Cc1cccc(c1)C)/C(=O)Nc1cccc(c1C)C

STK552406
Synonyms: 11- (1,3- benzodioxol- 5- ylmethyl)- 3- (prop- 2- en- 1- yl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: C=CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccc2c(c1)OCO2

STK552407
Synonyms: 4- (4- bromophenyl)- 6- (tricyclo[3.3.1.1~3,7~]dec- 2- yl)- 3,4- dihydropyrimidine- 2(1H)- thione
Smiles: S=C1NC(=CC(N1)c1ccc(cc1)Br)C1C2CC3CC1CC(C2)C3

STK552408
Synonyms: 3- (2- methoxyphenyl)- 2- [(3- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: COc1ccccc1n1c(SCc2cccc(c2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK552409
Synonyms: (5Z)- 3- (2- bromophenyl)- 5- [(2E)- 2- methyl- 3- phenylprop- 2- en- 1- ylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: C/C(=C\c1ccccc1)/C=C/1\SC(=S)N(C1=O)c1ccccc1Br

STK552410
Synonyms: 2- (2- fluorophenyl)- 4- (naphthalen- 1- yloxy)quinazoline
Smiles: Fc1ccccc1c1nc(Oc2cccc3c2cccc3)c2c(n1)cccc2

STK552411
Synonyms: 11- (5- bromofuran- 2- yl)- N- (3- chloro- 4- methoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(cc1Cl)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(o2)Br)c(nn1c1ccccc1)C

STK552412
Synonyms: 4- [(Z)- 2- cyano- 2- {4- [4- (2- methylpropyl)phenyl]- 1,3- thiazol- 2- yl}ethenyl]- 2- methoxyphenylacetate
Smiles: N#C/C(=C/c1ccc(c(c1)OC)OC(=O)C)/c1scc(n1)c1ccc(cc1)CC(C)C

STK552413
Synonyms: 10- butyl- 3- (methylsulfanyl)- 7,8,9,11a- tetrahydro- 6bH- cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncn1c3nnc1SC

STK552414
Synonyms: (8R,8aS,11aR)- 10- (2,4- dichlorophenyl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1Cl)Cl)cccc3

STK552416
Synonyms: (5Z)- 1- [4- (butan- 2- yl)phenyl]- 5- {[1- (2- fluorobenzyl)- 1H- indol- 3- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccccc2F)/C1=O)C

STK552417
Synonyms: (5E)- 1- (2,5- dimethylphenyl)- 5- (furan- 2- ylmethylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1ccc(c(c1)N1C(=O)NC(=O)/C(=C\c2ccco2)/C1=O)C

STK552423
Synonyms: 12- (2- methylprop- 2- en- 1- yl)- 9- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 5H- spiro[benzo[h][1,2,4]triazolo[3,4- b]quinazoline- 6,1'- cyclopentan]- 7(12H)- one
Smiles: CC(=C)Cn1c2c3ccccc3CC3(c2c(=O)n2c1nnc2SCC(=C)C)CCCC3

STK552424
Synonyms: 4- [(8R,8aS,11aR)- 8- [(4- methoxyphenyl)carbonyl]- 9,11- dioxo- 8a,9,11a,11b- tetrahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazin- 10(11H)- yl]phenylacetate
Smiles: COc1ccc(cc1)C(=O)[C@H]1[C@H]2C(=O)N(C(=O)[C@H]2C2N1N=Cc1c2cccc1)c1ccc(cc1)OC(=O)C

STK552426
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (2,3- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1C)C)C

STK552428
Synonyms: N- {3- [bis(2- methylpropyl)amino]- 2- hydroxypropyl}- N- (4- methoxyphenyl)- 4- methylbenzenesulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)C)CC(CN(CC(C)C)CC(C)C)O

STK552429
Synonyms: 3- (4- methylphenyl)- 3- [4- (propan- 2- yloxy)phenyl]propanimidicacid
Smiles: OC(=N)CC(c1ccc(cc1)C)c1ccc(cc1)OC(C)C

STK552431
Synonyms: 4- [4- (2,4- diphenyl- 1H- imidazol- 5- yl)phenyl]- 2,5- diphenyl- 1H- imidazole
Smiles: c1ccc(cc1)c1[nH]c(nc1c1ccc(cc1)c1[nH]c(nc1c1ccccc1)c1ccccc1)c1ccccc1

STK552432
Synonyms: 2- (4- benzylpiperazin- 1- yl)- N'- [(1E)- 1- (biphenyl- 4- yl)ethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccccc1)N/N=C(/c1ccc(cc1)c1ccccc1)\C

STK552433
Synonyms: 4- (4- tert- butylphenoxy)- 2- (pyridin- 2- yl)quinazoline
Smiles: CC(c1ccc(cc1)Oc1nc(nc2c1cccc2)c1ccccn1)(C)C

STK552434
Synonyms: (2E)- 2- (5- benzyl- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene)- 2- cyano- N- (4- ethylphenyl)ethanamide
Smiles: CCc1ccc(cc1)NC(=O)/C(=C\1/SC(C(=O)N1c1ccccc1)Cc1ccccc1)/C#N

STK552435
Synonyms: 3,5- diethyl- 2- [(3- hydroxypropyl)amino]- 5- methyl- 5,6- dihydrobenzo[h]quinazolin- 4(3H)- one
Smiles: OCCCNc1nc2c3ccccc3CC(c2c(=O)n1CC)(C)CC

STK552437
Synonyms: 2- {4- [(4- chlorophenyl)amino]quinazolin- 2- yl}- 6- methoxyphenol
Smiles: COc1cccc(c1O)c1nc(Nc2ccc(cc2)Cl)c2c(n1)cccc2

STK552439
Synonyms: 2- (4- butoxyphenyl)- 4- [(4- fluorobenzyl)sulfanyl]- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCCCOc1ccc(cc1)c1nc(SCc2ccc(cc2)F)c2c(n1)sc1c2CC(OC1)(C)C

STK552442
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {2- [(2- chlorobenzyl)oxy]- 3- methoxyphenyl}methylidene]- 5- (3- nitrophenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cccc(c1OCc1ccccc1Cl)/C=N/NC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N

STK552443
Synonyms: (2E)- 2- [4- (3- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(3,4,5- trimethoxyphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(c(c1)OC)OC)/c1scc(n1)c1cccc(c1)Br

STK552444
Synonyms: N- (2- methoxy- 5- methylphenyl)- 2- ({5- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(s1)SCc1cccc2c1cccc2)C

STK552445
Synonyms: 2- (4- benzylpiperazin- 1- yl)- N'- [(1Z)- 1- (4- chlorophenyl)ethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccccc1)N/N=C(\c1ccc(cc1)Cl)/C

STK552448
Synonyms: 5- (4- ethylphenyl)- 3- (3- nitrophenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: CCc1ccc(cc1)N1C(=O)C2C(C1=O)ON(C2c1cccc(c1)[N+](=O)[O-])c1ccccc1

STK552449
Synonyms: (9E)- 9- (4- chlorobenzylidene)- 5- (4- chlorophenyl)- 3- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 7- methyl- 6,7,8,9- tetrahydro- 5H- pyrido[4,3- d][1,3]thiazolo[3,2- a]pyrimidine
Smiles: CN1C/C(=C\c2ccc(cc2)Cl)/C2=C(C1)C(c1ccc(cc1)Cl)n1c(=N2)scc1c1ccc2c(c1)OCCO2

STK552450
Synonyms: (8R,8aS,11aR)- 8- [(4- methoxyphenyl)carbonyl]- 10- (naphthalen- 2- yl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc2c(c1)cccc2)cccc3

STK552451
Synonyms: (5Z)- 1- (3- chloro- 4- methylphenyl)- 5- ({1- [2- (3,5- dimethylphenoxy)ethyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1cc(OCCn2cc(c3c2cccc3)/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc(c(c2)Cl)C)cc(c1)C

STK552452
Synonyms: 4- [(2E)- 2- (4- chlorobenzylidene)hydrazinyl]- 2- (2- fluorophenyl)quinazoline
Smiles: Clc1ccc(cc1)/C=N/Nc1nc(nc2c1cccc2)c1ccccc1F

STK552454
Synonyms: N- (4- phenylbutan- 2- yl)- 2- [(2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- yl)sulfanyl]acetamide
Smiles: CC(NC(=O)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C)CCc1ccccc1

STK552455
Synonyms: 2- [4- (4- nitrophenoxy)quinazolin- 2- yl]phenol
Smiles: Oc1ccccc1c1nc(Oc2ccc(cc2)[N+](=O)[O-])c2c(n1)cccc2

STK552457
Synonyms: 2- amino- 1- (2- methylpropyl)- N- (2- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CC(Cn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCc1ccccc1)C

STK552458
Synonyms: (8R,8aS,11aR)- 10- (1,3- benzodioxol- 5- yl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc2c(c1)OCO2)cccc3

STK552459
Synonyms: 3- {[(E)- (4- fluorophenyl)methylidene]amino}- 8- methoxy- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1nc(C)n(c(=O)c1[nH]2)/N=C/c1ccc(cc1)F

STK552460
Synonyms: ethyl7- ({[4- (3- chlorophenyl)piperazin- 1- yl]acetyl}amino)- 5H- [1,3]dioxolo[4,5- f]indole- 6- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)Cl)cc1c(c2)OCO1

STK552462
Synonyms: 11- (4- butylphenyl)- 2- methyl- 3- (tetrahydrofuran- 2- ylmethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)CC1CCCO1

STK552463
Synonyms: 4- [(2E)- 2- (4- chlorobenzylidene)hydrazinyl]- 2- [4- (propan- 2- yloxy)phenyl]quinazoline
Smiles: CC(Oc1ccc(cc1)c1nc(N/N=C/c2ccc(cc2)Cl)c2c(n1)cccc2)C

STK552464
Synonyms: ethyl3- ({3- [4- (3- chlorophenyl)piperazin- 1- yl]propanoyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1cccc(c1)Cl)cccc2

STK552465
Synonyms: 3- methyl- 7- {[2- (2- methylpiperidin- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: Cc1ccc2c(c1)oc1c([nH]2)c2c(c(c1)NCCN1CCCCC1C)c(=O)c1c(c2=O)cccc1

STK552466
Synonyms: N- [(1E)- 1- [4- (dimethylamino)phenyl]- 3- {[2- (1H- indol- 3- yl)ethyl]amino}- 3- oxoprop- 1- en- 2- yl]- 4- methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)N/C(=C/c1ccc(cc1)N(C)C)/C(=O)NCCc1c[nH]c2c1cccc2

STK552467
Synonyms: 7- (4- methylphenyl)- 3- (3- nitrophenyl)- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: Cc1ccc(cc1)N1C(=O)CC2(C1=O)ON=C(C2)c1cccc(c1)[N+](=O)[O-]

STK552469
Synonyms: 4,4'- {sulfonylbis[(6- chlorobenzene- 3,1- diyl)sulfonyl]}dimorpholine
Smiles: Clc1ccc(cc1S(=O)(=O)N1CCOCC1)S(=O)(=O)c1ccc(c(c1)S(=O)(=O)N1CCOCC1)Cl

STK552470
Synonyms: 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N- (3- methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC)CCCCC3

STK552471
Synonyms: 7- {[2- (4- benzylpiperazin- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: O=c1c2ccccc2c(=O)c2c1c1[nH]c3ccccc3oc1cc2NCCN1CCN(CC1)Cc1ccccc1

STK552473
Synonyms: (8R,8aS,11aR)- 8- (2,2- dimethylpropanoyl)- 10- (4- nitrophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: O=C1N(c2ccc(cc2)[N+](=O)[O-])C(=O)[C@@H]2[C@H]1[C@@H](N1C2c2ccccc2C=N1)C(=O)C(C)(C)C

STK552476
Synonyms: 2- [(4- bromobenzyl)sulfanyl]- 6,6- dimethyl- 3- (3- methylphenyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Cc1cccc(c1)n1c(SCc2ccc(cc2)Br)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552477
Synonyms: 2- ({5- [(4- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)- N'- [(E)- (2- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)CSc1nnc(s1)SCc1ccc(cc1)Cl

STK552478
Synonyms: N- (3- chloro- 4- methylphenyl)- 11- (4- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Fc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)C)c1ccccc1

STK552479
Synonyms: ethyl4- {2- [(E)- 2- (2- hydroxyphenyl)ethenyl]- 6- iodo- 4- oxoquinazolin- 3(4H)- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(/C=C/c2ccccc2O)nc2c(c1=O)cc(cc2)I

STK552480
Synonyms: 11- (3- chlorophenyl)- N- (2,4- dimethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(c(c1)OC)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)Cl)c(nn1c1ccccc1)C

STK552481
Synonyms: 2- (4- chlorophenyl)- 3- [5- (4- iodophenoxy)pentyl]quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1ccc(cc1)I

STK552482
Synonyms: (1'S,2'S,3R,3a'R)- 1'- (2,2- dimethylpropanoyl)- 2'- [(4- methoxyphenyl)carbonyl]- 1',2'- dihydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C

STK552483
Synonyms: (5Z)- 2- [(2- chlorophenyl)amino]- 5- (3,4,5- trimethoxybenzylidene)- 1,3- thiazol- 4(5H)- one
Smiles: COc1cc(/C=C/2\SC(=NC2=O)Nc2ccccc2Cl)cc(c1OC)OC

STK552484
Synonyms: (2'R,3'R)- 2'- (2,5- dimethoxyphenyl)- 3'- [(4- methoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1cc(OC)ccc1OC)C(=O)c1c(C2=O)cccc1)cccc3

STK552485
Synonyms: 6- chloro- N- [(2- methoxydibenzo[b,d]furan- 3- yl)carbamothioyl]pyridine- 3- carboxamide
Smiles: COc1cc2c(cc1NC(=S)NC(=O)c1ccc(nc1)Cl)oc1c2cccc1

STK552486
Synonyms: 7- {[2- (4- methylpiperazin- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: CN1CCN(CC1)CCNc1cc2oc3ccccc3[nH]c2c2c1c(=O)c1ccccc1c2=O

STK552487
Synonyms: N,N- dimethyl- N'- (8- methyl- 5H- pyrimido[5,4- b]indol- 4- yl)propane- 1,3- diamine
Smiles: CN(CCCNc1ncnc2c1[nH]c1c2cc(cc1)C)C

STK552488
Synonyms: 2- [(2- chlorobenzyl)sulfanyl]- 6,6- dimethyl- 3- (3- methylphenyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Cc1cccc(c1)n1c(SCc2ccccc2Cl)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552489
Synonyms: 2- (butylsulfanyl)- 6- propyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CCCCSc1nc(N)c2c(n1)sc1c2CC(OC1)CCC

STK552491
Synonyms: 3- [(3- fluorobenzyl)sulfanyl]- 10,10- dimethyl- 5- (methylsulfanyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1cccc(c1)F)nn2)CC(OC3)(C)C

STK552493
Synonyms: 2- {[5- (furan- 2- yl)- 2,2- dimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccco1

STK552494
Synonyms: 2- (diethylamino)ethyl4- ({(Z)- 2- cyano- 2- [4- (4- ethoxyphenyl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzoate
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C\Nc1ccc(cc1)C(=O)OCCN(CC)CC)/C#N

STK552496
Synonyms: N- (4- methoxyphenyl)- 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3

STK552497
Synonyms: (5E)- 5- [(1- acetyl- 1H- indol- 3- yl)methylidene]- 1- (3- chloro- 4- methylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)/C(=C\c2cn(c3c2cccc3)C(=O)C)/C(=O)N1c1ccc(c(c1)Cl)C

STK552499
Synonyms: 4- (2,4- dichlorophenyl)- N,N- diethyl- 3a,4,5,9b- tetrahydro- 3H- cyclopenta[c]quinoline- 8- carboxamide
Smiles: CCN(C(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccc(cc1Cl)Cl)CC

STK552502
Synonyms: ethyl2- {[6- iodo- 3- (4- methoxyphenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}propanoate
Smiles: CCOC(=O)C(Sc1nc2ccc(cc2c(=O)n1c1ccc(cc1)OC)I)C

STK552504
Synonyms: 2- (4- chloro- 3- fluorophenyl)- 3a,4,7,7a- tetrahydro- 1H- spiro[2- aza- 4,7- methanoisoindole- 8,1'- cyclopropane]- 1,3(2H)- dione
Smiles: O=C1N(c2ccc(c(c2)F)Cl)C(=O)C2C1C1C=CC2C21CC2

STK552505
Synonyms: 2- [(E)- 2- (4- hydroxyphenyl)ethenyl]- 6- iodo- 3- (4- nitrophenyl)quinazolin- 4(3H)- one
Smiles: Oc1ccc(cc1)/C=C/c1nc2ccc(cc2c(=O)n1c1ccc(cc1)[N+](=O)[O-])I

STK552507
Synonyms: 3- chloro- N- [(3- chloro- 1- benzothiophen- 2- yl)carbonyl]- N- (4,6- dimethylpyrimidin- 2- yl)- 1- benzothiophene- 2- carboxamide
Smiles: Cc1cc(C)nc(n1)N(C(=O)c1sc2c(c1Cl)cccc2)C(=O)c1sc2c(c1Cl)cccc2

STK552508
Synonyms: methyl1- acetyl- 7- (3,4- dichlorophenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: COC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1ccc(c(c1)Cl)Cl)C(=O)C

STK552509
Synonyms: 4- {(1E)- 1- [2- ({1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazol- 4- yl}carbonyl)hydrazinylidene]ethyl}phenylbenzoate
Smiles: CC1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(cc1)OC(=O)c1ccccc1)\C

STK552510
Synonyms: (2E)- 2- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]- 3- [(3,4,5- trimethoxyphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(c(c1)OC)OC)/c1scc(n1)c1ccc(c(c1)OC)OC

STK552511
Synonyms: (8S,8aR,11aS,11bS)- 10- (2,4- dimethoxyphenyl)- 8- (2,2- dimethylpropanoyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(c(c1)OC)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2c2ccccc2C=C1)C(=O)C(C)(C)C

STK552512
Synonyms: dimethyl5- ({(Z)- 2- cyano- 2- [4- (thiophen- 2- yl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzene- 1,3- dicarboxylate
Smiles: N#C/C(=C/Nc1cc(cc(c1)C(=O)OC)C(=O)OC)/c1scc(n1)c1cccs1

STK552513
Synonyms: 9- bromo- 2- (furan- 2- yl)- 5- (3- nitrophenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: Brc1ccc2c(c1)C1CC(=NN1C(O2)c1cccc(c1)[N+](=O)[O-])c1ccco1

STK552514
Synonyms: ethyl3- {[3- (3,5- dimethylpiperidin- 1- yl)propanoyl]amino}- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CC(C)CC(C1)C)cc(c(c2)OC)OC

STK552515
Synonyms: 2- [(2E)- 3- (3,4- dimethoxyphenyl)prop- 2- enoyl]- 5- methoxyphenylmorpholine- 4- carboxylate
Smiles: COc1ccc(c(c1)OC(=O)N1CCOCC1)C(=O)/C=C/c1ccc(c(c1)OC)OC

STK552516
Synonyms: (1'R,2'S,7a'S)- 2'- [(4- fluorophenyl)carbonyl]- 5',6',7',7a'- tetrahydrodispiro[indene- 2,3'- pyrrolizine- 1',3''- indole]- 1,2'',3(1''H)- trione
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1[C@@]2(C(=O)c3c(C2=O)cccc3)N2[C@H]([C@]31C(=O)Nc1c3cccc1)CCC2

STK552518
Synonyms: 11- (3,4- dichlorophenyl)- N- (3,4- dimethylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1nn(c2c1C(c1ccc(c(c1)Cl)Cl)n1c(=N2)c(Nc2ccc(c(c2)C)C)nc2c1cccc2)c1ccccc1

STK552519
Synonyms: 2- [4- (3- methylbutoxy)phenyl]- 5H- spiro[benzo[h][1,2,4]triazolo[1,5- c]quinazoline- 4,1'- cyclohexane]
Smiles: CC(CCOc1ccc(cc1)c1nn2c(n1)c1c(nc2)c2ccccc2CC21CCCCC2)C

STK552522
Synonyms: 2- [(3- benzyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl)sulfanyl]- N,N- dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCC3)CCC

STK552523
Synonyms: N- (2- ethoxyphenyl)- 11- (2- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccccc1Nc1nc2ccccc2n2c1=Nc1c(C2c2ccccc2F)c(nn1c1ccccc1)C

STK552524
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- 1- (3,4- dimethoxyphenyl)ethanone
Smiles: COc1cc(ccc1OC)C(=O)CSc1nnc(s1)SCc1ccccc1

STK552525
Synonyms: 2- (4- chlorophenyl)- 3- [5- (3- phenoxyphenoxy)pentyl]quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1cccc(c1)Oc1ccccc1

STK552526
Synonyms: N- (2- methoxyphenyl)- 2- {[3- (4- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2OC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552527
Synonyms: methyl4- {6- [(3- chloro- 4- methylphenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccc(c(c1)Cl)C)nc1c2cccc1

STK552528
Synonyms: 2- amino- 1- (3,4- dimethoxyphenyl)- N- (3- methoxypropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COCCCNC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccc(c(c1)OC)OC

STK552529
Synonyms: 1- (dicyclohexylamino)- 3- (4- nitrophenoxy)propan- 2- ol
Smiles: OC(CN(C1CCCCC1)C1CCCCC1)COc1ccc(cc1)[N+](=O)[O-]

STK552531
Synonyms: (5Z)- 3- (naphthalen- 2- yl)- 2- thioxo- 5- (3,4,5- trimethoxybenzylidene)- 1,3- thiazolidin- 4- one
Smiles: COc1cc(/C=C/2\SC(=S)N(C2=O)c2ccc3c(c2)cccc3)cc(c1OC)OC

STK552532
Synonyms: N- carbamoyl- 4- ({(E)- 2- cyano- 2- [4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzenesulfonamide
Smiles: N#C/C(=C\Nc1ccc(cc1)S(=O)(=O)NC(=O)N)/c1scc(n1)c1ccc(cc1)OC

STK552533
Synonyms: N- (4- {2- amino- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 1- yl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccc(cc1)C

STK552534
Synonyms: 2- [(2- methylbenzyl)sulfanyl]- 3- (2- methylphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Cc1ccccc1CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3

STK552535
Synonyms: (2Z)- N- (4- chlorophenyl)- 2- [(5E)- 5- {[5- (3- chlorophenyl)furan- 2- yl]methylidene}- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]- 2- cyanoethanamide
Smiles: N#C/C(=c\1/s/c(=C/c2ccc(o2)c2cccc(c2)Cl)/c(=O)n1c1ccccc1)/C(=O)Nc1ccc(cc1)Cl

STK552536
Synonyms: {(1R,2S,3R)- 2- [4- (dimethylamino)phenyl]- 1- nitro- 1,2,3,10b- tetrahydropyrrolo[2,1- a]phthalazin- 3- yl}(4- methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)[C@H]1[C@H](c2ccc(cc2)N(C)C)[C@H](C2N1N=Cc1c2cccc1)[N+](=O)[O-]

STK552540
Synonyms: (5Z)- 1- (4- fluorophenyl)- 5- [(1- {2- [2- (prop- 2- en- 1- yl)phenoxy]ethyl}- 1H- indol- 3- yl)methylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: C=CCc1ccccc1OCCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)F

STK552541
Synonyms: 8- [(2,4- dichlorobenzyl)sulfanyl]- 5- (furan- 2- yl)- 2,2- dimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: Clc1ccc(c(c1)Cl)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccco1

STK552542
Synonyms: methyl1- acetyl- 7- (4- chlorophenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: COC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1ccc(cc1)Cl)C(=O)C

STK552543
Synonyms: 11- propyl- 3- (propylsulfanyl)- 7,8,9,10- tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: CCCSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)CCC

STK552544
Synonyms: 2- [4- (propan- 2- yloxy)phenyl]- 5H- spiro[benzo[h][1,2,4]triazolo[1,5- c]quinazoline- 4,1'- cyclohexane]
Smiles: CC(Oc1ccc(cc1)c1nn2c(n1)c1c(nc2)c2ccccc2CC21CCCCC2)C

STK552548
Synonyms: (2Z)- 2- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]- 2- cyano- N- (furan- 2- ylmethyl)ethanamide
Smiles: N#C/C(=c\1/s/c(=C\c2ccccc2Cl)/c(=O)n1c1ccccc1)/C(=O)NCc1ccco1

STK552549
Synonyms: (2E)- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl][2- (4- fluorophenyl)hydrazinylidene]ethanenitrile
Smiles: N#C/C(=N\Nc1ccc(cc1)F)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK552551
Synonyms: (8R,8aS,11aR)- 8- acetyl- 10- (naphthalen- 2- yl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: CC(=O)[C@H]1[C@H]2C(=O)N(C(=O)[C@H]2C2N1N=Cc1c2cccc1)c1ccc2c(c1)cccc2

STK552552
Synonyms: 2'- [(4- methoxyphenyl)carbamoyl]biphenyl- 2- carboxylicacid
Smiles: COc1ccc(cc1)NC(=O)c1ccccc1c1ccccc1C(=O)O

STK552553
Synonyms: 2- [(2,4- dichlorobenzyl)sulfanyl]- 5- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,3,4- thiadiazole
Smiles: Clc1ccc(c(c1)Cl)CSc1nnc(s1)SCc1cccc2c1cccc2

STK552558
Synonyms: 2- {[6- iodo- 3- (2- methylphenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}- N,N- dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2ccc(cc2c(=O)n1c1ccccc1C)I)CCC

STK552559
Synonyms: 2- methoxy- 6- {4- [(3- methoxyphenyl)amino]quinazolin- 2- yl}phenol
Smiles: COc1cccc(c1)Nc1nc(nc2c1cccc2)c1cccc(c1O)OC

STK552560
Synonyms: (4aS,4bR,7aS,8R)- 6- (3- fluorophenyl)- 8- [(3- nitrophenyl)carbonyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: Fc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H]1N([C@H]2C(=O)c2cccc(c2)[N+](=O)[O-])N=CC=C1

STK552561
Synonyms: N- (4- chlorophenyl)- 2- (4- ethylpiperazin- 1- yl)- 5- nitropyrimidine- 4,6- diamine
Smiles: CCN1CCN(CC1)c1nc(Nc2ccc(cc2)Cl)c(c(n1)N)[N+](=O)[O-]

STK552562
Synonyms: (9E)- 3- (4- bromophenyl)- 9- (4- chlorobenzylidene)- 5- (4- chlorophenyl)- 7- methyl- 6,7,8,9- tetrahydro- 5H- pyrido[4,3- d][1,3]thiazolo[3,2- a]pyrimidine
Smiles: CN1C/C(=C\c2ccc(cc2)Cl)/C2=C(C1)C(c1ccc(cc1)Cl)n1c(=N2)scc1c1ccc(cc1)Br

STK552563
Synonyms: 2- (chloromethyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: ClCc1nn2c(n1)c1c(nc2)sc2c1CCCC2

STK552565
Synonyms: 4- [(2,6- dichlorobenzyl)sulfanyl]- 2- (methylsulfanyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine
Smiles: CSc1nc(SCc2c(Cl)cccc2Cl)c2c(n1)sc1c2CCCC1

STK552566
Synonyms: 2- (methoxycarbonyl)phenyl4- (3- nitrophenyl)- 3a,4,5,9b- tetrahydro- 3H- cyclopenta[c]quinoline- 8- carboxylate
Smiles: COC(=O)c1ccccc1OC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1cccc(c1)[N+](=O)[O-]

STK552567
Synonyms: ethyl3- ({3- [4- (2- fluorophenyl)piperazin- 1- yl]propanoyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1F)cccc2

STK552570
Synonyms: 4- {[({5- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)acetyl]amino}benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(s1)SCc1cccc2c1cccc2

STK552572
Synonyms: 3- tert- butyl- 7- {[2- (3,3- dimethylpiperidin- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: O=c1c2c3[nH]c4ccc(cc4oc3cc(c2c(=O)c2c1cccc2)NCCN1CCCC(C1)(C)C)C(C)(C)C

STK552574
Synonyms: ethyl7- [(pyrrolidin- 1- ylacetyl)amino]- 5H- [1,3]dioxolo[4,5- f]indole- 6- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCCC1)cc1c(c2)OCO1

STK552575
Synonyms: (4bR,7aS,8R)- 8- [(4- methoxyphenyl)carbonyl]- 6- [3- (trifluoromethyl)phenyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=CC=CC2[C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F

STK552577
Synonyms: 3- {[(E)- (4- hydroxy- 3- methoxyphenyl)methylidene]amino}- 8- methoxy- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1nc(C)n(c(=O)c1[nH]2)/N=C/c1ccc(c(c1)OC)O

STK552580
Synonyms: 1- amino- 5- (morpholin- 4- yl)- N,N- diphenyl- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1)N(c1ccccc1)c1ccccc1

STK552581
Synonyms: 5- (naphthalen- 1- yl)- 3- (3- nitrophenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: O=C1C2C(c3cccc(c3)[N+](=O)[O-])N(OC2C(=O)N1c1cccc2c1cccc2)c1ccccc1

STK552582
Synonyms: 1- (1- benzyl- 5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- [4- (pyridin- 2- yl)piperazin- 1- yl]ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1ccccn1)c(n2Cc1ccccc1)C

STK552583
Synonyms: (2'R,3'R)- 3'- (2,2- dimethylpropanoyl)- 2'- (furan- 2- yl)- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: O=C(C(C)(C)C)[C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1ccco1)C(=O)c1c(C2=O)cccc1)cccc3

STK552584
Synonyms: 2- {4- [(2,3- dimethylphenyl)amino]quinazolin- 2- yl}- 6- methoxyphenol
Smiles: COc1cccc(c1O)c1nc(Nc2cccc(c2C)C)c2c(n1)cccc2

STK552585
Synonyms: 2- [2- ({4- amino- 6- [(4- chlorophenyl)amino]- 5- nitropyrimidin- 2- yl}amino)ethoxy]ethanol
Smiles: OCCOCCNc1nc(Nc2ccc(cc2)Cl)c(c(n1)N)[N+](=O)[O-]

STK552586
Synonyms: 1- ethyl- 6- fluoro- 7- (4- methylpiperazin- 1- yl)- 4- oxo- N- (tetrahydrofuran- 2- ylmethyl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)NCC2CCCO2)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK552588
Synonyms: 4- [(3- chloro- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl)amino]benzoicacid
Smiles: ClC1=C(Nc2ccc(cc2)C(=O)O)C(=O)c2c(C1=O)cccc2

STK552589
Synonyms: 4- [4- methyl- 6- (4- nitrophenoxy)pyrimidin- 2- yl]morpholine
Smiles: Cc1cc(Oc2ccc(cc2)[N+](=O)[O-])nc(n1)N1CCOCC1

STK552590
Synonyms: 8- chloro- 3- methyl- 10- (4- methylphenyl)pyrimido[4,5- b]quinoline- 2,4(3H,10H)- dione
Smiles: Cc1ccc(cc1)n1c2cc(Cl)ccc2cc2c1nc(=O)n(c2=O)C

STK552591
Synonyms: 4- [(4- fluorobenzyl)sulfanyl]- 2- (methylsulfanyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine
Smiles: CSc1nc(SCc2ccc(cc2)F)c2c(n1)sc1c2CCCC1

STK552592
Synonyms: 1- (5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- [4- (4- methoxyphenyl)- 3- methylpiperazin- 1- yl]ethanone
Smiles: COc1ccc(cc1)N1CCN(CC1C)CC(=O)c1c(C)[nH]c2c1cc(OC)cc2

STK552593
Synonyms: N- (4- ethylphenyl)- 10- methyl- 8- phenyl- 11- (3,4,5- trimethoxyphenyl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cc(OC)c(c(c2)OC)OC)c(nn1c1ccccc1)C

STK552594
Synonyms: ethyl7- {[(3- methylpiperidin- 1- yl)acetyl]amino}- 5H- [1,3]dioxolo[4,5- f]indole- 6- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCCC(C1)C)cc1c(c2)OCO1

STK552596
Synonyms: N- (3- chloro- 4- methylphenyl)- 11- (3,4- dimethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(cc1OC)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)C)c1ccccc1

STK552599
Synonyms: 1- ethyl- 2- imino- 8- methyl- 3- [(4- methylphenyl)sulfonyl]- 1,2- dihydro- 5H- dipyrido[1,2- a:2',3'- d]pyrimidin- 5- one
Smiles: CCn1c2nc3ccc(cn3c(=O)c2cc(c1=N)S(=O)(=O)c1ccc(cc1)C)C

STK552600
Synonyms: 4- ({(E)- 2- cyano- 2- [4- (naphthalen- 1- yl)- 1,3- thiazol- 2- yl]ethenyl}amino)- N- (1,3- thiazol- 2- yl)benzenesulfonamide
Smiles: N#C/C(=C\Nc1ccc(cc1)S(=O)(=O)Nc1nccs1)/c1scc(n1)c1cccc2c1cccc2

STK552602
Synonyms: (4bR,7aS,8R)- 8- (phenylcarbonyl)- 6- [2- (trifluoromethyl)phenyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: O=C([C@@H]1N2N=CC=CC2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1C(F)(F)F)c1ccccc1

STK552604
Synonyms: 2- [(10- butyl- 7,8,9,11a- tetrahydro- 6bH- cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]- N- (4- methylphenyl)acetamide
Smiles: CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncn1c3nnc1SCC(=O)Nc1ccc(cc1)C

STK552605
Synonyms: 2- methoxy- N- [2- (naphthalen- 2- yl)imidazo[1,2- a]pyridin- 3- yl]benzamide
Smiles: COc1ccccc1C(=O)Nc1c(nc2n1cccc2)c1ccc2c(c1)cccc2

STK552607
Synonyms: (5E)- 5- (3,4- dimethoxybenzylidene)- 1- (2,4- dimethylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1OC)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1C)C

STK552608
Synonyms: N~2~- (3- methoxypropyl)- N~4~- (3- methylphenyl)- 5- nitropyrimidine- 2,4,6- triamine
Smiles: COCCCNc1nc(Nc2cccc(c2)C)c(c(n1)N)[N+](=O)[O-]

STK552610
Synonyms: 3- benzyl- 6- iodo- 2- [(E)- 2- (3- nitrophenyl)ethenyl]quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1cccc(c1)[N+](=O)[O-])Cc1ccccc1

STK552612
Synonyms: (1'S,2'S,3R,3a'R)- 1'- [(3- bromo- 4- methoxyphenyl)carbonyl]- 2'- (furan- 2- ylcarbonyl)- 1',2'- dihydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2c3ccccc3C=C[C@@H]2[C@]2([C@@H]1C(=O)c1ccco1)C(=O)Nc1c2cccc1

STK552614
Synonyms: N'- [2- (methylsulfanyl)- 6,7- dihydro- 5H- cyclopenta[4,5]thieno[2,3- d]pyrimidin- 4- yl]acetohydrazide
Smiles: CSc1nc(NNC(=O)C)c2c(n1)sc1c2CCC1

STK552615
Synonyms: 6- (propan- 2- yl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CC(C1OCc2c(C1)c1c(N)ncnc1s2)C

STK552617
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [3- (benzyloxy)phenyl]methylidene}- 5- (3- nitrophenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)N/N=C/c1cccc(c1)OCc1ccccc1

STK552620
Synonyms: 2- [5- (3- bromophenyl)- 3- (4- methoxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- (4- methylphenyl)quinazoline
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1cccc(c1)Br)c1nc2ccccc2c(n1)c1ccc(cc1)C

STK552621
Synonyms: ethyl[(4- amino- 6- propyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]acetate
Smiles: CCCC1OCc2c(C1)c1c(N)nc(nc1s2)SCC(=O)OCC

STK552622
Synonyms: N- cyclopentyl- 1- (2- hydroxyethyl)- 2- imino- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: OCCn1c(=N)c(cc2c1nc1ccccn1c2=O)C(=O)NC1CCCC1

STK552623
Synonyms: 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N,N- diphenylacetamide
Smiles: CCn1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK552624
Synonyms: 3- ethyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCn1cnc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK552628
Synonyms: 5- methyl- 3- phenyl- N- {[2- (pyridin- 4- ylcarbonyl)hydrazinyl]carbonothioyl}- 1,2- oxazole- 4- carboxamide
Smiles: S=C(NC(=O)c1c(C)onc1c1ccccc1)NNC(=O)c1ccncc1

STK552629
Synonyms: 3- butyl- 2- (butylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCCSc1nc2c3ccccc3CC3(c2c(=O)n1CCCC)CCCC3

STK552630
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N- (2- methoxy- 5- methylphenyl)acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(s1)SCc1ccccc1)C

STK552631
Synonyms: N- (4- bromophenyl)- 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK552632
Synonyms: 9- (2,4- dichlorophenyl)- 5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8(9H)- one
Smiles: Clc1ccc(c(c1)Cl)n1cnc2c(c1=O)sc1c2c2CCCCc2c(n1)N1CCOCC1

STK552633
Synonyms: 5- ethyl- 10,10- dimethyl- 3- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCc1nc2sc3c(c2c2n1c(SCC(=C)C)nn2)CC(OC3)(C)C

STK552634
Synonyms: 2- (4- chlorophenyl)- 3- [5- (4- methylphenoxy)pentyl]quinazolin- 4(3H)- one
Smiles: Cc1ccc(cc1)OCCCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK552636
Synonyms: methyl1- acetyl- 7- (4- bromophenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: COC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1ccc(cc1)Br)C(=O)C

STK552637
Synonyms: 2- amino- N- [2- (cyclohex- 1- en- 1- yl)ethyl]- 1- (2,4- dimethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1cc(OC)ccc1n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCC1=CCCCC1

STK552638
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- ethoxy- 4- [(3- methylbenzyl)oxy]phenyl}methylidene]- 5- (piperidin- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CN2CCCCC2)c2nonc2N)ccc1OCc1cccc(c1)C

STK552640
Synonyms: N- [2- hydroxy- 3- (2- methyl- 1H- imidazol- 1- yl)propyl]- 4- methyl- N- (3- nitrophenyl)benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N(c1cccc(c1)[N+](=O)[O-])CC(Cn1ccnc1C)O

STK552641
Synonyms: 2- [(3- benzyl- 6- iodo- 4- oxo- 3,4- dihydroquinazolin- 2- yl)sulfanyl]- N,N- dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)I)CCC

STK552642
Synonyms: 2- (biphenyl- 4- yl)- 4- (thiophen- 2- yl)- 1,4- dihydropyrimido[1,2- a]benzimidazole
Smiles: c1ccc(cc1)c1ccc(cc1)C1=CC(n2c(N1)nc1c2cccc1)c1cccs1

STK552643
Synonyms: ethyl2- [(4- benzylpiperazin- 1- yl)methyl]- 6- bromo- 1- cyclohexyl- 5- hydroxy- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(O)c(cc2n(c1CN1CCN(CC1)Cc1ccccc1)C1CCCCC1)Br

STK552644
Synonyms: (5Z)- 5- ({1- [3- (3,4- dimethylphenoxy)propyl]- 1H- indol- 3- yl}methylidene)- 1- (furan- 2- ylmethyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\c1cn(c2c1cccc2)CCCOc1ccc(c(c1)C)C)Cc1ccco1

STK552645
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {2- [(2- chloro- 6- fluorobenzyl)oxy]- 4- (diethylamino)phenyl}methylidene]- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCN(c1ccc(c(c1)OCc1c(F)cccc1Cl)/C=N/NC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)CC

STK552646
Synonyms: methyl(1R,2S,3S,3aS)- 1- {[4- (acetyloxy)phenyl]carbonyl}- 3- cyano- 2- (4- methoxyphenyl)- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinoline- 3- carboxylate
Smiles: COc1ccc(cc1)[C@@H]1[C@H](C(=O)c2ccc(cc2)OC(=O)C)N2[C@H]([C@@]1(C#N)C(=O)OC)C=Cc1c2cccc1

STK552647
Synonyms: 1- (3,4- dimethylphenyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- amine
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c2nc3ccccc3nc2n(c1N)c1ccc(c(c1)C)C

STK552648
Synonyms: (5Z)- 5- ({1- [2- (4- chloro- 3- methylphenoxy)ethyl]- 1H- indol- 3- yl}methylidene)- 1- (4- fluorophenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCOc2ccc(c(c2)C)Cl)/C1=O

STK552649
Synonyms: (9E)- 3- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 9- (4- fluorobenzylidene)- 5- (4- fluorophenyl)- 7- methyl- 6,7,8,9- tetrahydro- 5H- pyrido[4,3- d][1,3]thiazolo[3,2- a]pyrimidine
Smiles: CN1C/C(=C\c2ccc(cc2)F)/C2=C(C1)C(c1ccc(cc1)F)n1c(=N2)scc1c1ccc2c(c1)OCCO2

STK552651
Synonyms: ethyl4- ({(2E)- 2- cyano- 2- [(5E)- 4- oxo- 3- phenyl- 5- (3,4,5- trimethoxybenzylidene)- 1,3- thiazolidin- 2- ylidene]acetyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)/C(=c\1/s/c(=C/c2cc(OC)c(c(c2)OC)OC)/c(=O)n1c1ccccc1)/C#N

STK552654
Synonyms: (6aS,6bR,9aS,10R)- 8- (4- butoxyphenyl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: CCCCOc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK552656
Synonyms: 3- [(2- chlorobenzyl)sulfanyl]- 5- (2- chlorophenyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: Clc1ccccc1c1nc2sc3c(c2c2n1c(SCc1ccccc1Cl)nn2)CCCC3

STK552657
Synonyms: N~6~- (4- iodophenyl)- N~4~,N~4~- dimethyl- 7- nitro- 2,1,3- benzoxadiazole- 4,6- diamine
Smiles: Ic1ccc(cc1)Nc1cc(N(C)C)c2c(c1[N+](=O)[O-])non2

STK552659
Synonyms: (5Z)- 5- (4- hydroxy- 3- methoxybenzylidene)- 3- [(4- nitrophenyl)amino]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)Nc1ccc(cc1)[N+](=O)[O-]

STK552660
Synonyms: {3- [4- (4- fluorophenyl)piperazin- 1- yl]quinoxalin- 2- yl}(4- methoxyphenyl)acetonitrile
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)c1ccc(cc1)F)c1ccc(cc1)OC

STK552661
Synonyms: prop- 2- en- 1- yl2- amino- 1- (3- chloro- 4- fluorophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)F

STK552664
Synonyms: 7- [(3- methylbutyl)sulfanyl]- 4- (propan- 2- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CC(CCSc1ncnc2c1sc1c2c2CCCc2c(n1)C(C)C)C

STK552666
Synonyms: 2- (3,5- dimethyl- 1H- pyrazol- 1- yl)cyclohexyl3- phenylpropanoate
Smiles: O=C(OC1CCCCC1n1nc(cc1C)C)CCc1ccccc1

STK552667
Synonyms: N- (3- chloro- 4- methylphenyl)- 11- (2,3- dimethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1cccc(c1OC)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)C)c1ccccc1

STK552669
Synonyms: 4- (butylsulfanyl)- 6,6- dimethyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCCCSc1nc(SC)nc2c1c1CC(C)(C)OCc1s2

STK552670
Synonyms: 2- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 3- (4- methoxyphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552671
Synonyms: 2- (2H- benzotriazol- 2- yl)- 6- chloro- 4- phenylquinoline
Smiles: Clc1ccc2c(c1)c(cc(n2)n1nc2c(n1)cccc2)c1ccccc1

STK552672
Synonyms: 2- (2- bromo- 4,5- diphenyl- 1H- imidazol- 1- yl)- 1- (4- ethylphenyl)ethanone
Smiles: CCc1ccc(cc1)C(=O)Cn1c(Br)nc(c1c1ccccc1)c1ccccc1

STK552673
Synonyms: (2E)- 3- {[2- (difluoromethoxy)phenyl]amino}- 2- (4- phenyl- 1,3- thiazol- 2- yl)prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC(F)F)/c1scc(n1)c1ccccc1

STK552674
Synonyms: 2- {[5- (4- tert- butylphenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1E,2E)- 3- (2- nitrophenyl)prop- 2- en- 1- ylidene]acetohydrazide
Smiles: CCn1c(SCC(=O)N/N=C/C=C/c2ccccc2[N+](=O)[O-])nnc1c1ccc(cc1)C(C)(C)C

STK552675
Synonyms: 1- (1- benzyl- 5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- [4- (3- chlorophenyl)piperazin- 1- yl]ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1cccc(c1)Cl)c(n2Cc1ccccc1)C

STK552676
Synonyms: (1'S,2'S,3R,3a'R)- 2'- [(4- bromophenyl)carbonyl]- 1'- (2,2- dimethylpropanoyl)- 1',2'- dihydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C

STK552677
Synonyms: 6- hydroxy- 1- (2- methylphenyl)- 3- phenyl- 5- (1,2,3,4- tetrahydroisoquinolin- 1- ylacetyl)- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: Cc1ccccc1n1c(O)c(C(=O)CC2NCCc3c2cccc3)c(=O)n(c1=S)c1ccccc1

STK552678
Synonyms: 2- [(E)- 2- (5- bromo- 2- hydroxyphenyl)ethenyl]- 6- iodo- 3- (3- nitrophenyl)quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1cc(Br)ccc1O)c1cccc(c1)[N+](=O)[O-]

STK552679
Synonyms: 2- (4- ethylpiperazin- 1- yl)- N- (furan- 2- ylmethyl)- 5- nitropyrimidine- 4,6- diamine
Smiles: CCN1CCN(CC1)c1nc(NCc2ccco2)c(c(n1)N)[N+](=O)[O-]

STK552680
Synonyms: (3E)- 4- (4- {[3- chloro- 5,6- difluoro- 2- (morpholin- 4- yl)pyridin- 4- yl]oxy}phenyl)but- 3- en- 2- one
Smiles: CC(=O)/C=C/c1ccc(cc1)Oc1c(F)c(F)nc(c1Cl)N1CCOCC1

STK552681
Synonyms: N- (3- methoxyphenyl)- 2- {[4- oxo- 3- (prop- 2- en- 1- yl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2)OC)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552682
Synonyms: 3- (3- methylphenyl)- 2- [(naphthalen- 2- ylmethyl)sulfanyl]- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)c1cccc(c1)C)SCc1ccc2c(c1)cccc2)C

STK552683
Synonyms: 4- [(2E)- 2- (4- fluorobenzylidene)hydrazinyl]- 2- (2- fluorophenyl)quinazoline
Smiles: Fc1ccc(cc1)/C=N/Nc1nc(nc2c1cccc2)c1ccccc1F

STK552685
Synonyms: 3- ethyl- 2- (hexylsulfanyl)- 6- iodoquinazolin- 4(3H)- one
Smiles: CCCCCCSc1nc2ccc(cc2c(=O)n1CC)I

STK552686
Synonyms: 1- (4- fluorophenyl)- 2- [(5,10,10- trimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]ethanone
Smiles: O=C(c1ccc(cc1)F)CSc1nnc2n1c(C)nc1c2c2CC(C)(C)OCc2s1

STK552687
Synonyms: 4- (3- methylpiperidin- 1- yl)- 2- [4- (propan- 2- yloxy)phenyl]quinazoline
Smiles: CC1CCCN(C1)c1nc(nc2c1cccc2)c1ccc(cc1)OC(C)C

STK552688
Synonyms: 2- [(2,4- dichlorobenzyl)sulfanyl]- 3- ethyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCn1c(SCc2ccc(cc2Cl)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK552689
Synonyms: N- (2- ethoxyphenyl)- 10- methyl- 8- phenyl- 11- (thiophen- 2- yl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccccc1Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cccs1)C)c1ccccc1

STK552690
Synonyms: 2- (diethylamino)ethyl4- ({(Z)- 2- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 2- cyanoethenyl}amino)benzoate
Smiles: CCN(CCOC(=O)c1ccc(cc1)N/C=C(\c1scc(n1)c1ccc(cc1)Cl)/C#N)CC

STK552692
Synonyms: (2E)- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- [(3,4,5- trimethoxyphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(c(c1)OC)OC)/c1scc(n1)c1cc2ccccc2oc1=O

STK552693
Synonyms: 2- {[4- (4- methylphenyl)- 5- oxo- 4,5,7,8- tetrahydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}- N- (2- phenylethyl)acetamide
Smiles: O=C(CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CCC3)NCCc1ccccc1

STK552694
Synonyms: 2- [(4- fluorobenzyl)sulfanyl]- 6,6- dimethyl- 3- (3- methylphenyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Cc1cccc(c1)n1c(SCc2ccc(cc2)F)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552697
Synonyms: N,N- dibutyl- 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3)CCCC

STK552698
Synonyms: 2- [4- (4- benzylpiperazin- 1- yl)quinazolin- 2- yl]phenol
Smiles: Oc1ccccc1c1nc2ccccc2c(n1)N1CCN(CC1)Cc1ccccc1

STK552700
Synonyms: 3- (2- chlorophenyl)- 6- iodo- 2- [(E)- 2- phenylethenyl]quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccccc1)c1ccccc1Cl

STK552701
Synonyms: N- (4- bromophenyl)- 2- {(2E)- 2- [(2E)- (2- hydroxybenzylidene)hydrazinylidene]- 4- oxo- 1,3- thiazolidin- 5- yl}acetamide
Smiles: O=C(CC1S/C(=N/N=C/c2ccccc2O)/NC1=O)Nc1ccc(cc1)Br

STK552702
Synonyms: 1- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 4- (2- phenylethyl)- 6,7,8,9- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CCCC3

STK552704
Synonyms: 2- [4- (hexyloxy)phenyl]- 5H- spiro[benzo[h][1,2,4]triazolo[1,5- c]quinazoline- 4,1'- cyclohexane]
Smiles: CCCCCCOc1ccc(cc1)c1nn2c(n1)c1c(nc2)c2ccccc2CC21CCCCC2

STK552705
Synonyms: 2- [(2- chlorobenzyl)sulfanyl]- 6- propyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CCCC1OCc2c(C1)c1c(N)nc(nc1s2)SCc1ccccc1Cl

STK552707
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [4- (propan- 2- yl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1

STK552708
Synonyms: 11- (3,4- dimethoxyphenyl)- N- (4- ethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(c(c2)OC)OC)c(nn1c1ccccc1)C

STK552709
Synonyms: N- (diphenylmethyl)- 2- {[5- (furan- 2- yl)- 2,2- dimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- yl]sulfanyl}acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccco1

STK552710
Synonyms: (1'R,2'R,3a'S)- 1'- (2,2- dimethylpropanoyl)- 2'- (4- methoxyphenyl)- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: COc1ccc(cc1)[C@H]1[C@@H](N2[C@H]([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C

STK552711
Synonyms: 2- {[2- (methylsulfanyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl]amino}ethanol
Smiles: OCCNc1nc(SC)nc2c1c1CCCCc1s2

STK552712
Synonyms: N- (4- chlorophenyl)- 2- {[3- (3- methylphenyl)- 4- oxo- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C

STK552713
Synonyms: N- (4- bromophenyl)- 11- (4- tert- butylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Brc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)C(C)(C)C)C)c1ccccc1

STK552714
Synonyms: 3- (2,5- dimethylphenyl)- 2- methyl- 11- (3- methylphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Cc1ccc(c(c1)n1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2c1cccc(c1)C)C

STK552715
Synonyms: 4- chloro- N- [(1E)- 1- (3,4- diethoxyphenyl)- 3- oxo- 3- (phenylamino)prop- 1- en- 2- yl]benzamide
Smiles: CCOc1cc(ccc1OCC)/C=C(\C(=O)Nc1ccccc1)/NC(=O)c1ccc(cc1)Cl

STK552716
Synonyms: 2- (methoxycarbonyl)phenyl4- (4- bromophenyl)- 3a,4,5,9b- tetrahydro- 3H- cyclopenta[c]quinoline- 8- carboxylate
Smiles: COC(=O)c1ccccc1OC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccc(cc1)Br

STK552717
Synonyms: 2- [(6- iodo- 4- oxo- 3- phenyl- 3,4- dihydroquinazolin- 2- yl)sulfanyl]- N,N- dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2ccc(cc2c(=O)n1c1ccccc1)I)CCC

STK552718
Synonyms: 9- fluoro- 7- hydroxy- 3- methyl- 5- oxo- N- (3- phenylpropyl)- 2,3- dihydro- 1H,5H- pyrido[3,2,1- ij]quinoline- 6- carboxamide
Smiles: Fc1cc2CCC(n3c2c(c1)c(O)c(c3=O)C(=O)NCCCc1ccccc1)C

STK552720
Synonyms: 2- [(Z)- (5- bromo- 1- ethyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)methyl]- 3- (3- methylphenyl)quinazolin- 4(3H)- one
Smiles: CCN1c2ccc(cc2/C(=C/c2nc3ccccc3c(=O)n2c2cccc(c2)C)/C1=O)Br

STK552721
Synonyms: N- (2- fluorophenyl)- 2- (pyridin- 2- yl)quinazolin- 4- amine
Smiles: Fc1ccccc1Nc1nc(nc2c1cccc2)c1ccccn1

STK552722
Synonyms: 2- (butylsulfanyl)- 3- (2- methylpropyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCSc1nc2c3ccccc3CC3(c2c(=O)n1CC(C)C)CCCCC3

STK552724
Synonyms: 2- {[6- iodo- 3- (2- methoxyphenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: COc1ccccc1n1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)cc(cc2)I

STK552725
Synonyms: methyl[(4- amino- 6,8- diphenyl- 5,8- dihydro- 6H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]acetate
Smiles: COC(=O)CSc1nc(N)c2c(n1)sc1c2CC(SC1c1ccccc1)c1ccccc1

STK552728
Synonyms: 3- (3- chlorophenyl)- 1- (prop- 2- en- 1- yl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine- 2,4(1H,3H)- dione
Smiles: C=CCn1c2sc3c(c2c(=O)n(c1=O)c1cccc(c1)Cl)CCCC3

STK552731
Synonyms: 1- (3,4- dichlorophenyl)- 3- [(3,5- dimethyl- 1H- pyrazol- 1- yl)methyl]pyrrolidine- 2,5- dione
Smiles: O=C1CC(C(=O)N1c1ccc(c(c1)Cl)Cl)Cn1nc(cc1C)C

STK552732
Synonyms: (5E)- 1- (2,5- dimethoxyphenyl)- 5- (4- methoxy- 3- nitrobenzylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(c(c1)N1C(=O)NC(=O)/C(=C\c2ccc(c(c2)[N+](=O)[O-])OC)/C1=O)OC

STK552733
Synonyms: 5- (3- chlorophenyl)- 3- (4- hydroxyphenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: Oc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1cccc(c1)Cl)c1ccccc1

STK552734
Synonyms: N- (3- chloro- 4- methylphenyl)- 11- (2- methoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)C)c1ccccc1

STK552735
Synonyms: 4- {6- [(3,4- dimethylphenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}- 2- methoxyphenol
Smiles: COc1cc(ccc1O)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)C)C)c1ccccc1

STK552736
Synonyms: methyl[(4- amino- 6- propyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]acetate
Smiles: CCCC1OCc2c(C1)c1c(N)nc(nc1s2)SCC(=O)OC

STK552737
Synonyms: (8R,8aS,11aR)- 10- (2- methoxyphenyl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1OC)cccc3

STK552739
Synonyms: 4- {[(2- methyl- 4- nitro- 1H- imidazol- 5- yl)sulfanyl]methyl}- 2- nitrophenol
Smiles: Cc1[nH]c(c(n1)[N+](=O)[O-])SCc1ccc(c(c1)[N+](=O)[O-])O

STK552740
Synonyms: 5- bromo- 4- [(2E)- 2- (4- chlorobenzylidene)hydrazinyl]- 2- (pyrrolidin- 1- yl)pyrimidine
Smiles: Clc1ccc(cc1)/C=N/Nc1nc(ncc1Br)N1CCCC1

STK552741
Synonyms: 11- (4- butylphenyl)- 3- (2,5- dimethylphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)c1cc(C)ccc1C

STK552742
Synonyms: (2Z)- 2- [(5E)- 5- (4- chlorobenzylidene)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]- N- (4- chlorophenyl)- 2- cyanoethanamide
Smiles: N#C/C(=c\1/s/c(=C/c2ccc(cc2)Cl)/c(=O)n1c1ccccc1)/C(=O)Nc1ccc(cc1)Cl

STK552744
Synonyms: 11- (4- chlorophenyl)- N- (2- ethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccccc1Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)Cl)C)c1ccccc1

STK552746
Synonyms: ethyl1- acetyl- 7- (4- methoxyphenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: CCOC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1ccc(cc1)OC)C(=O)C

STK552747
Synonyms: 2- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 1- (5- methoxy- 2- methyl- 1H- indol- 3- yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)Cc1ccc3c(c1)OCO3)c([nH]2)C

STK552749
Synonyms: 1- (4- chlorophenyl)- 2- [(5- ethyl- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]ethanone
Smiles: CCc1nc2sc3c(c2c2n1c(SCC(=O)c1ccc(cc1)Cl)nn2)CC(OC3)(C)C

STK552750
Synonyms: 3- bromo- N- [2- (morpholin- 4- yl)ethyl]- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: O=C(c1coc(=O)c(c1)Br)NCCN1CCOCC1

STK552752
Synonyms: N'- (8- chloro- 5H- pyrimido[5,4- b]indol- 4- yl)- N,N- dimethylpropane- 1,3- diamine
Smiles: CN(CCCNc1ncnc2c1[nH]c1c2cc(cc1)Cl)C

STK552753
Synonyms: 1- (piperidin- 1- yl)- 2- [4- (4- {[3- (trifluoromethyl)phenyl]amino}phthalazin- 1- yl)phenoxy]ethanone
Smiles: O=C(N1CCCCC1)COc1ccc(cc1)c1nnc(c2c1cccc2)Nc1cccc(c1)C(F)(F)F

STK552754
Synonyms: (2E)- 2- (4- phenyl- 1,3- thiazol- 2- yl)- 3- [(3,4,5- trimethoxyphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cc(OC)c(c(c1)OC)OC)/c1scc(n1)c1ccccc1

STK552756
Synonyms: N- (2- {(2Z)- 2- [1- (4- chlorophenyl)ethylidene]hydrazinyl}- 2- oxoethyl)- 2- phenylacetamide(non- preferredname)
Smiles: O=C(N/N=C(\c1ccc(cc1)Cl)/C)CNC(=O)Cc1ccccc1

STK552757
Synonyms: 1- (1- benzyl- 5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- [4- (4- nitrophenyl)piperazin- 1- yl]ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])c(n2Cc1ccccc1)C

STK552759
Synonyms: 7- bromo- 1- (3- bromophenyl)- 5- phenyl[1,2,4]triazolo[4,3- a]quinoline
Smiles: Brc1cccc(c1)c1nnc2n1c1ccc(cc1c(c2)c1ccccc1)Br

STK552761
Synonyms: 2- [(2,4- dimethylbenzyl)sulfanyl]- 3- (4- methoxyphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2C)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552762
Synonyms: (8R,8aS,11aR)- 10- (2- chlorophenyl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1Cl)cccc3

STK552764
Synonyms: N- (3- methylphenyl)- 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3

STK552765
Synonyms: 1- (3- chloro- 4- methoxyphenyl)- 2- phenyl- 1H- imidazo[4,5- b]quinoxaline
Smiles: COc1ccc(cc1Cl)n1c(nc2c1nc1ccccc1n2)c1ccccc1

STK552766
Synonyms: 2- methoxy- 6- {4- [(3- methoxypropyl)amino]quinazolin- 2- yl}phenol
Smiles: COCCCNc1nc(nc2c1cccc2)c1cccc(c1O)OC

STK552767
Synonyms: (5Z)- 3- (3,5- dichlorophenyl)- 5- (3- ethoxy- 4- hydroxybenzylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCOc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)c1cc(Cl)cc(c1)Cl

STK552768
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- [4- (diphenylmethyl)piperazin- 1- yl]ethanone
Smiles: Cc1ccc2c(c1)[nH]c(c2C(=O)CN1CCN(CC1)C(c1ccccc1)c1ccccc1)C

STK552769
Synonyms: 3- ({(E)- [4- (decyloxy)phenyl]methylidene}amino)- 8- methoxy- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCCCCCCCCCOc1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cc(cc1)OC

STK552770
Synonyms: (2Z)- 2- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]- 3- {[2- (trifluoromethyl)phenyl]amino}prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1ccccc1C(F)(F)F)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK552771
Synonyms: 3- (2- methylprop- 2- en- 1- yl)- 2- {[2- oxo- 2- (piperidin- 1- yl)ethyl]sulfanyl}- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CC(=C)Cn1c(SCC(=O)N2CCCCC2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552772
Synonyms: 6- iodo- 3- (naphthalen- 2- yl)- 2- [(E)- 2- (5- nitrofuran- 2- yl)ethenyl]quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(o1)[N+](=O)[O-])c1ccc2c(c1)cccc2

STK552773
Synonyms: 2- (benzylsulfanyl)- 4- hydrazinyl- 6H- spiro[benzo[h]quinazoline- 5,1'- cyclohexane]
Smiles: NNc1nc(SCc2ccccc2)nc2c1C1(CCCCC1)Cc1c2cccc1

STK552774
Synonyms: 2- benzyl- 2,3- dideoxy- 1- hydrazinyl- 5- O- propylpentose
Smiles: CCCOCC(CC(C(=O)NN)Cc1ccccc1)O

STK552775
Synonyms: ethyl3- ({3- [4- (2- methoxyphenyl)piperazin- 1- yl]propanoyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1OC)cccc2

STK552776
Synonyms: N- [2- (diethylamino)ethyl]- 9- fluoro- 7- hydroxy- 3- methyl- 5- oxo- 2,3- dihydro- 1H,5H- pyrido[3,2,1- ij]quinoline- 6- carboxamide
Smiles: CCN(CCNC(=O)c1c(O)c2cc(F)cc3c2n(c1=O)C(C)CC3)CC

STK552777
Synonyms: 2,8,8- trimethyl- 4- (prop- 2- en- 1- yloxy)- 7,10- dihydro- 8H- pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: C=CCOc1nc(C)nc2c1sc1c2cc2c(n1)CC(OC2)(C)C

STK552778
Synonyms: (2Z)- [2- (4- fluorophenyl)hydrazinylidene][4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)F)/c1scc(n1)c1ccc(cc1)OC

STK552779
Synonyms: ethyl{[6- ethyl- 6- methyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc(SC)nc2c1c1CC(C)(CC)OCc1s2

STK552780
Synonyms: ethyl4- {[(2E,5Z)- 5- (3,4- diethoxybenzylidene)- 3- methyl- 4- oxo- 1,3- thiazolidin- 2- ylidene]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)/N=C\1/S/C(=C\c2ccc(c(c2)OCC)OCC)/C(=O)N1C

STK552782
Synonyms: 3- {[(E)- (5- chloro- 2- hydroxy- 3- nitrophenyl)methylidene]amino}- 2- propylquinazolin- 4(3H)- one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1cc(Cl)cc(c1O)[N+](=O)[O-]

STK552783
Synonyms: N- (3,4- dimethylphenyl)- 7- (4- methylpiperidin- 1- yl)- 4- nitro- 2,1,3- benzoxadiazol- 5- amine
Smiles: CC1CCN(CC1)c1cc(Nc2ccc(c(c2)C)C)c(c2c1non2)[N+](=O)[O-]

STK552785
Synonyms: 5- ethyl- 10,10- dimethyl- 3- (prop- 2- en- 1- ylsulfanyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: C=CCSc1nnc2n1c(CC)nc1c2c2CC(C)(C)OCc2s1

STK552786
Synonyms: 4- chloro- N- (3- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}quinoxalin- 2- yl)benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1N1CCN(CC1)c1cccc(c1)C(F)(F)F

STK552787
Synonyms: butyl4- [(6aR,6bS,9aR,10S)- 10- [(4- nitrophenyl)carbamoyl]- 7,9- dioxo- 6b,7,9a,10- tetrahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinolin- 8(9H)- yl]benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK552788
Synonyms: N- (furan- 2- ylmethyl)- 2- (4- methylpiperazin- 1- yl)- 5- nitropyrimidine- 4,6- diamine
Smiles: CN1CCN(CC1)c1nc(NCc2ccco2)c(c(n1)N)[N+](=O)[O-]

STK552791
Synonyms: [5- (4- bromophenyl)- 1',3'- diphenyl- 3,4- dihydro- 1'H,2H- 3,4'- bipyrazol- 2- yl](4- methylphenyl)methanone
Smiles: Cc1ccc(cc1)C(=O)N1N=C(CC1c1cn(nc1c1ccccc1)c1ccccc1)c1ccc(cc1)Br

STK552794
Synonyms: 2- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 3- (2- methylpropyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CC(Cn1c(SCC(=C)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1)C

STK552796
Synonyms: 7,9- dibromo- 6- butyl- 6H- indolo[2,3- b]quinoxaline
Smiles: CCCCn1c2nc3ccccc3nc2c2c1c(Br)cc(c2)Br

STK552798
Synonyms: N- [3- (pentafluorophenoxy)phenyl]- 2- (pyridin- 3- yl)piperidine- 1- carboxamide
Smiles: O=C(N1CCCCC1c1cccnc1)Nc1cccc(c1)Oc1c(F)c(F)c(c(c1F)F)F

STK552800
Synonyms: 2- (benzylsulfanyl)- 3- (furan- 2- ylmethyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: O=c1n(Cc2ccco2)c(SCc2ccccc2)nc2c1C1(CCCC1)Cc1c2cccc1

STK552801
Synonyms: (5E)- 1- (2,5- dimethoxyphenyl)- 5- (4- methoxybenzylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1)/C=C/1\C(=O)NC(=O)N(C1=O)c1cc(OC)ccc1OC

STK552802
Synonyms: (6aS,6bR,9aS,10R)- 8- (2- methoxy- 5- nitrophenyl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: COc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H]1N([C@H]2C(=O)Nc2ccc(cc2)[N+](=O)[O-])c2ccccc2C=C1)[N+](=O)[O-]

STK552804
Synonyms: 2- (diethylamino)ethyl4- ({(Z)- 2- cyano- 2- [4- (4- fluorophenyl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzoate
Smiles: CCN(CCOC(=O)c1ccc(cc1)N/C=C(\c1scc(n1)c1ccc(cc1)F)/C#N)CC

STK552805
Synonyms: 3- (4- methoxyphenyl)- 6,6- dimethyl- 2- [(naphthalen- 2- ylmethyl)sulfanyl]- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: COc1ccc(cc1)n1c(SCc2ccc3c(c2)cccc3)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552806
Synonyms: ethyl3- ({2- [4- (2- fluorophenyl)piperazin- 1- yl]propanoyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(CC1)c1ccccc1F)C)cccc2

STK552808
Synonyms: 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC)CCCCC3

STK552809
Synonyms: 3- (3,5- dimethylphenyl)- 2- methyl- 11- (4- methylphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Cc1ccc(cc1)n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)c1cc(C)cc(c1)C

STK552811
Synonyms: (8R,8aS,11aR)- 10- (4- butoxyphenyl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: CCCCOc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1C2c2ccccc2C=N1)C(=O)c1ccc(cc1)OC

STK552812
Synonyms: 6- iodo- 2- [(E)- 2- (3- methylphenyl)ethenyl]- 3- (naphthalen- 1- yl)quinazolin- 4(3H)- one
Smiles: Cc1cccc(c1)/C=C/c1nc2ccc(cc2c(=O)n1c1cccc2c1cccc2)I

STK552815
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {2- [(2- chloro- 6- fluorobenzyl)oxy]- 3- methoxyphenyl}methylidene]- 5- (morpholin- 4- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cccc(c1OCc1c(F)cccc1Cl)/C=N/NC(=O)c1nnn(c1CN1CCOCC1)c1nonc1N

STK552816
Synonyms: N- benzyl- 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3)NCc1ccccc1

STK552818
Synonyms: 2- {[3- (4- methoxyphenyl)- 6,6- dimethyl- 4- oxo- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc3c2cccc3)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552819
Synonyms: 3- (furan- 2- ylmethyl)- 2- [(3- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Cc1cccc(c1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3

STK552820
Synonyms: (3a'R,8a'S,8b'S)- 2'- (2- methoxy- 5- nitrophenyl)- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indene- 2,4'- pyrrolo[3,4- a]pyrrolizine]- 1,1',3,3'(2'H)- tetrone
Smiles: COc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@]1(N3[C@H]2CCC3)C(=O)c2c(C1=O)cccc2)[N+](=O)[O-]

STK552821
Synonyms: 2,4- dibromo- 6- [(E)- {[2- (naphthalen- 2- yl)imidazo[1,2- a]pyridin- 3- yl]imino}methyl]phenol
Smiles: Brc1cc(/C=N/c2c(nc3n2cccc3)c2ccc3c(c2)cccc3)c(c(c1)Br)O

STK552822
Synonyms: 2- {[2- (4- butoxyphenyl)- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]sulfanyl}acetamide
Smiles: CCCCOc1ccc(cc1)c1nc(SCC(=O)N)c2c(n1)sc1c2CC(OC1)(C)C

STK552823
Synonyms: 2- {[2- (4- butoxyphenyl)- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]sulfanyl}- N- (3- methoxyphenyl)acetamide
Smiles: CCCCOc1ccc(cc1)c1nc(SCC(=O)Nc2cccc(c2)OC)c2c(n1)sc1c2CC(OC1)(C)C

STK552825
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(4- chlorophenyl)carbonyl]- 3'- (2,2- dimethylpropanoyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C

STK552826
Synonyms: (6aR,6bS,9aR,10S)- 8- (naphthalen- 2- yl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: O=C([C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc3c(c1)cccc3)C=Cc1c2cccc1)Nc1ccc(cc1)[N+](=O)[O-]

STK552828
Synonyms: ethyl{[2- (4- butoxyphenyl)- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]sulfanyl}acetate
Smiles: CCCCOc1ccc(cc1)c1nc(SCC(=O)OCC)c2c(n1)sc1c2CC(OC1)(C)C

STK552829
Synonyms: dimethyl5- ({(E)- 2- cyano- 2- [4- (naphthalen- 1- yl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzene- 1,3- dicarboxylate
Smiles: N#C/C(=C\Nc1cc(cc(c1)C(=O)OC)C(=O)OC)/c1scc(n1)c1cccc2c1cccc2

STK552830
Synonyms: 2- {[4- (4- ethoxyphenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C(F)(F)F)nnc1c1cccnc1

STK552832
Synonyms: 2- [(2,4- dichlorobenzyl)sulfanyl]- 3- (4- methoxyphenyl)- 6,6- dimethyl- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2Cl)Cl)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552833
Synonyms: N~6~- (3,4- dimethylphenyl)- N~4~,N~4~- dimethyl- 7- nitro- 2,1,3- benzoxadiazole- 4,6- diamine
Smiles: Cc1cc(ccc1C)Nc1cc(N(C)C)c2c(c1[N+](=O)[O-])non2

STK552835
Synonyms: ethyl5,6- dimethoxy- 3- ({[4- (4- methoxyphenyl)- 3- methylpiperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(C(C1)C)c1ccc(cc1)OC)cc(c(c2)OC)OC

STK552836
Synonyms: 2- (4- butoxyphenyl)- 4- [(2- chlorobenzyl)sulfanyl]- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCCCOc1ccc(cc1)c1nc(SCc2ccccc2Cl)c2c(n1)sc1c2CC(OC1)(C)C

STK552837
Synonyms: 6- ({2- [(4- chloro- 2,5- dimethoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (4- ethoxyphenyl)- 2- methyl- N- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: CCOc1ccc(cc1)C1C(=C(SCC(=O)Nc2cc(OC)c(cc2OC)Cl)NC(=C1C(=O)Nc1ccccc1)C)C#N

STK552838
Synonyms: 2- {2- [(4- amino- 6,8- diphenyl- 5,8- dihydro- 6H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]ethyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C1N(CCSc2nc(N)c3c(n2)sc2c3CC(SC2c2ccccc2)c2ccccc2)C(=O)c2c1cccc2

STK552839
Synonyms: 4- bromo- 2- {6- [(4- butylphenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}phenol
Smiles: CCCCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cc(Br)ccc1O)C)c1ccccc1

STK552840
Synonyms: 4- bromo- N- [(5Z)- 5- (2,5- dimethoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]benzamide
Smiles: COc1ccc(cc1/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)Br)OC

STK552841
Synonyms: 1- [(4- chlorobenzyl)sulfanyl]- 7,7- dimethyl- 4- phenyl- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Clc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CC(OC3)(C)C

STK552842
Synonyms: 2- methoxyethyl2- amino- 1- [3- (trifluoromethyl)phenyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)C(F)(F)F

STK552843
Synonyms: 4- [(2E)- 2- (2,4- dichlorobenzylidene)hydrazinyl]- 2- [4- (propan- 2- yloxy)phenyl]quinazoline
Smiles: CC(Oc1ccc(cc1)c1nc(N/N=C/c2ccc(cc2Cl)Cl)c2c(n1)cccc2)C

STK552844
Synonyms: 3- {5- [(4- tert- butylbenzyl)sulfanyl]- 4- (4- ethoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}pyridine
Smiles: CCOc1ccc(cc1)n1c(SCc2ccc(cc2)C(C)(C)C)nnc1c1cccnc1

STK552847
Synonyms: 2- (1,3- benzothiazol- 2- ylsulfanyl)- N'- [(E)- 1H- indol- 2- ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nc2c(s1)cccc2)N/N=C/c1cc2c([nH]1)cccc2

STK552848
Synonyms: 1- (1- benzyl- 5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- [4- (2,3- dimethylphenyl)piperazin- 1- yl]ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1cccc(c1C)C)c(n2Cc1ccccc1)C

STK552849
Synonyms: (8S,8aR,11aS,11bS)- 8- (2,2- dimethylpropanoyl)- 10- (3- fluorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Fc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)C(C)(C)C)C=Cc2c1cccc2

STK552850
Synonyms: 4- (benzyloxy)- N- [(5Z)- 5- (3- ethoxy- 4- hydroxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]benzamide
Smiles: CCOc1cc(ccc1O)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)OCc1ccccc1

STK552851
Synonyms: 2- {[5- (2- chlorophenyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}acetamide
Smiles: NC(=O)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1Cl

STK552852
Synonyms: 2- [(4- bromobenzyl)sulfanyl]- 6,6- dimethyl- 3- (4- methylphenyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Cc1ccc(cc1)n1c(SCc2ccc(cc2)Br)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552853
Synonyms: 1- (4- butylphenyl)- 2- (4- chlorophenyl)- 1H- imidazo[4,5- b]quinoxaline
Smiles: CCCCc1ccc(cc1)n1c(nc2c1nc1ccccc1n2)c1ccc(cc1)Cl

STK552854
Synonyms: 2- (3- {(Z)- [2- (1- benzofuran- 2- ylcarbonyl)hydrazinylidene]methyl}- 1H- indol- 1- yl)- N- phenylacetamide
Smiles: O=C(Cn1cc(c2c1cccc2)/C=N\NC(=O)c1cc2c(o1)cccc2)Nc1ccccc1

STK552855
Synonyms: 2- [(Z)- (5- bromo- 1- ethyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)methyl]- 3- ethylquinazolin- 4(3H)- one
Smiles: CCN1C(=O)/C(=C\c2nc3ccccc3c(=O)n2CC)/c2c1ccc(c2)Br

STK552856
Synonyms: 2- bromo- N'- [6,6- dimethyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]benzohydrazide
Smiles: CSc1nc(NNC(=O)c2ccccc2Br)c2c(n1)sc1c2CC(OC1)(C)C

STK552857
Synonyms: 2- (4- chlorophenyl)- 3- (6- phenoxyhexyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCCOc1ccccc1

STK552859
Synonyms: 6- hydroxy- 5- (7- hydroxy- 6- methyl- 1,3- dihydrofuro[3,4- c]pyridin- 1- yl)- 1,3- diphenyl- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: Cc1ncc2c(c1O)C(OC2)c1c(O)n(c2ccccc2)c(=S)n(c1=O)c1ccccc1

STK552861
Synonyms: (2E)- 2- (acetylamino)- 3- [3- chloro- 5- ethoxy- 4- (propan- 2- yloxy)phenyl]prop- 2- enoicacid
Smiles: CCOc1cc(/C=C(\C(=O)O)/NC(=O)C)cc(c1OC(C)C)Cl

STK552862
Synonyms: 2- [(7,7- dimethyl- 2- phenyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl)sulfanyl]- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nc(nc2c1COC(C2)(C)C)c1ccccc1

STK552864
Synonyms: 4- butoxy- N'- [6,6- dimethyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]benzohydrazide
Smiles: CCCCOc1ccc(cc1)C(=O)NNc1nc(SC)nc2c1c1CC(C)(C)OCc1s2

STK552865
Synonyms: 1- (3- chlorophenyl)- 3- (piperidin- 1- ylmethyl)urea
Smiles: O=C(Nc1cccc(c1)Cl)NCN1CCCCC1

STK552866
Synonyms: N~6~- (2,5- dichlorophenyl)- N~4~- ethyl- 7- nitro- 2,1,3- benzoxadiazole- 4,6- diamine
Smiles: CCNc1cc(Nc2cc(Cl)ccc2Cl)c(c2c1non2)[N+](=O)[O-]

STK552867
Synonyms: 3- (4- bromophenyl)- 7- (4- chlorophenyl)- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: Clc1ccc(cc1)N1C(=O)CC2(C1=O)ON=C(C2)c1ccc(cc1)Br

STK552868
Synonyms: 4- [(2E)- 2- (2,4- dimethoxybenzylidene)hydrazinyl]- 2- [4- (propan- 2- yloxy)phenyl]quinazoline
Smiles: COc1cc(OC)ccc1/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1)OC(C)C

STK552870
Synonyms: 2- {[5- (methylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}- 1- (4- nitrophenyl)ethanone
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)c1ccc(cc1)[N+](=O)[O-])nn2)CCCC3

STK552872
Synonyms: N'- [(E)- (5- bromothiophen- 2- yl)methylidene]- 2- {[5- (4- tert- butylphenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: CCn1c(SCC(=O)N/N=C/c2ccc(s2)Br)nnc1c1ccc(cc1)C(C)(C)C

STK552873
Synonyms: 3- (furan- 2- ylmethyl)- 2- (propan- 2- ylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CC(Sc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3)C

STK552874
Synonyms: N- (2- chlorophenyl)- 2- (pyridin- 2- yl)quinazolin- 4- amine
Smiles: Clc1ccccc1Nc1nc(nc2c1cccc2)c1ccccn1

STK552875
Synonyms: (5Z)- 1- [4- (butan- 2- yl)phenyl]- 5- ({1- [2- (3- methylphenoxy)ethyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCOc2cccc(c2)C)/C1=O)C

STK552876
Synonyms: (1'S,2'S,3R,3a'R)- 1'- [(3- bromo- 4- methoxyphenyl)carbonyl]- 2'- [(4- chlorophenyl)carbonyl]- 1',2'- dihydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2c3ccccc3C=C[C@@H]2[C@]2([C@@H]1C(=O)c1ccc(cc1)Cl)C(=O)Nc1c2cccc1

STK552878
Synonyms: 2- (4- butoxyphenyl)- 4- [(4- chlorobenzyl)sulfanyl]- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCCCOc1ccc(cc1)c1nc(SCc2ccc(cc2)Cl)c2c(n1)sc1c2CC(OC1)(C)C

STK552879
Synonyms: (2'R,3'R)- 3'- [(4- chlorophenyl)carbonyl]- 2'- (2,4- dimethoxyphenyl)- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: COc1ccc(c(c1)OC)[C@H]1[C@H](C(=O)c2ccc(cc2)Cl)N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2

STK552880
Synonyms: (2'R,3'R)- 3'- (2,2- dimethylpropanoyl)- 2'- (4- nitrophenyl)- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: [O-][N+](=O)c1ccc(cc1)[C@H]1[C@@H](N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2)C(=O)C(C)(C)C

STK552882
Synonyms: N- (2,4- dimethylphenyl)- 2- {[4- oxo- 3- (prop- 2- en- 1- yl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2C)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552883
Synonyms: 9- (4- methylphenyl)- 5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8(9H)- one
Smiles: Cc1ccc(cc1)n1cnc2c(c1=O)sc1c2c2CCCCc2c(n1)N1CCOCC1

STK552885
Synonyms: 6- hydroxy- 3- (4- methoxyphenyl)- 5- (1,2,3,4- tetrahydroisoquinolin- 1- yl)- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: COc1ccc(cc1)n1c(=S)[nH]c(c(c1=O)C1NCCc2c1cccc2)O

STK552888
Synonyms: 1- amino- N- (2- methoxyphenyl)- 5- (morpholin- 4- yl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxamide
Smiles: COc1ccccc1NC(=O)c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1

STK552889
Synonyms: 3- {[7- (4- methylpiperidin- 1- yl)- 4- nitro- 2,1,3- benzoxadiazol- 5- yl]amino}phenol
Smiles: CC1CCN(CC1)c1cc(Nc2cccc(c2)O)c(c2c1non2)[N+](=O)[O-]

STK552890
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N'- [(E)- (4- ethoxy- 3- methoxyphenyl)methylidene]acetohydrazide
Smiles: CCOc1ccc(cc1OC)/C=N/NC(=O)CSc1nnc(s1)SCc1ccccc1

STK552892
Synonyms: (8R,8aS,11aR)- 10- (3- bromophenyl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)Br)cccc3

STK552893
Synonyms: {[3- (3- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetonitrile
Smiles: N#CCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCC3

STK552896
Synonyms: N- (4- chlorophenyl)- 2- {[4- (4- methylphenyl)- 5- oxo- 4,5,7,8- tetrahydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CCC3

STK552897
Synonyms: 2- [(5- ethyl- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetamide
Smiles: CCc1nc2sc3c(c2c2n1c(SCC(=O)N)nn2)CC(OC3)(C)C

STK552898
Synonyms: 2- {4- [4- (diphenylmethyl)piperazin- 1- yl]quinazolin- 2- yl}- 6- methoxyphenol
Smiles: COc1cccc(c1O)c1nc(N2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(n1)cccc2

STK552899
Synonyms: 4- [(1Z)- 1- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (phenoxymethyl)- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)ethyl]phenylbenzoate
Smiles: C/C(=N/NC(=O)c1nnn(c1COc1ccccc1)c1nonc1N)/c1ccc(cc1)OC(=O)c1ccccc1

STK552900
Synonyms: (2Z)- [4- (6- bromo- 2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl][2- (4- bromophenyl)hydrazinylidene]ethanenitrile
Smiles: N#C/C(=N/Nc1ccc(cc1)Br)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK552901
Synonyms: 2- phenyl- 5- [4- (trifluoromethyl)phenyl]- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: FC(c1ccc(cc1)C1Oc2ccccc2C2N1N=C(C2)c1ccccc1)(F)F

STK552902
Synonyms: 3- [6- (2- chloro- 4- methylphenoxy)hexyl]- 2- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCCOc1ccc(cc1Cl)C

STK552903
Synonyms: 1- [(2,4- dichlorobenzyl)sulfanyl]- 4- (3- methylphenyl)- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Cc1cccc(c1)n1c(=O)c2c3CC(OCc3sc2n2c1nnc2SCc1ccc(cc1Cl)Cl)C(C)C

STK552904
Synonyms: (5Z)- 1- (3- chloro- 4- methoxyphenyl)- 5- ({1- [2- (3- methylphenoxy)ethyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1Cl)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCOc2cccc(c2)C)/C1=O

STK552905
Synonyms: N- (4- methylphenyl)- 2- {[3- (3- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCC3

STK552906
Synonyms: 3- butyl- 6- hydroxy- 5- (1,2,3,4- tetrahydroisoquinolin- 1- yl)- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: CCCCn1c(=S)[nH]c(c(c1=O)C1NCCc2c1cccc2)O

STK552907
Synonyms: N- (2,4- dimethylphenyl)- 2- [(4,7,7- trimethyl- 5- oxo- 4,5,6,9- tetrahydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nnc2n1c1sc3c(c1c(=O)n2C)CC(OC3)(C)C

STK552910
Synonyms: 2- (2- {[3- (4- methoxyphenyl)- 6,6- dimethyl- 4- oxo- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}ethyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1ccc(cc1)n1c(SCCN2C(=O)c3c(C2=O)cccc3)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552911
Synonyms: N- (1,3- benzodioxol- 5- yl)- 11- (2,3- dimethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1cccc(c1OC)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc2c(c1)OCO2)c1ccccc1

STK552914
Synonyms: 2- (4- butoxyphenyl)- 6,6- dimethyl- 4- (propan- 2- ylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCCCOc1ccc(cc1)c1nc(SC(C)C)c2c(n1)sc1c2CC(OC1)(C)C

STK552915
Synonyms: N- (4- bromophenyl)- 4- (4- ethoxyphenyl)phthalazin- 1- amine
Smiles: CCOc1ccc(cc1)c1nnc(c2c1cccc2)Nc1ccc(cc1)Br

STK552916
Synonyms: 10- methyl- N- (3- methylphenyl)- 11- (3- nitrophenyl)- 8- (pyridin- 2- yl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1cccc(c1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cccc(c1)[N+](=O)[O-])C)c1ccccn1

STK552918
Synonyms: N- (2- methylphenyl)- 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCC3

STK552919
Synonyms: 4- [(2,4- dichlorobenzyl)sulfanyl]- 6- ethyl- 6- methyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCC1(C)OCc2c(C1)c1c(SCc3ccc(cc3Cl)Cl)nc(nc1s2)SC

STK552920
Synonyms: tert- butyl(8R,8aS,11aR)- 10- (4- acetylphenyl)- 9,11- dioxo- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 8- carboxylate
Smiles: CC(=O)c1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1C2c2ccccc2C=N1)C(=O)OC(C)(C)C

STK552921
Synonyms: (5E)- 1- (2,5- dimethoxyphenyl)- 5- (2- methoxybenzylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(c(c1)N1C(=O)NC(=O)/C(=C\c2ccccc2OC)/C1=O)OC

STK552924
Synonyms: 8- [(4- fluorobenzyl)sulfanyl]- 5- (furan- 2- yl)- 2,2- dimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: Fc1ccc(cc1)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccco1

STK552926
Synonyms: 4- [4- (morpholin- 4- yl)- 3- nitrophenyl]- N- phenylphthalazin- 1- amine
Smiles: [O-][N+](=O)c1cc(ccc1N1CCOCC1)c1nnc(c2c1cccc2)Nc1ccccc1

STK552927
Synonyms: 2- (diethylamino)ethyl4- ({(Z)- 2- cyano- 2- [4- (4- cyclohexylphenyl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzoate
Smiles: CCN(CCOC(=O)c1ccc(cc1)N/C=C(\c1scc(n1)c1ccc(cc1)C1CCCCC1)/C#N)CC

STK552929
Synonyms: (8R,8aS,11aR)- 10- (3- chlorophenyl)- N- (4- chlorophenyl)- 9,11- dioxo- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 8- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)Cl)cccc3

STK552930
Synonyms: (5Z)- 5- {[1- (2,6- dichlorobenzyl)- 1H- indol- 3- yl]methylidene}- 1- (4- ethylphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2c(Cl)cccc2Cl)/C1=O

STK552931
Synonyms: 2- ({2- [2- (5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- oxoethyl]- 1,2,3,4- tetrahydroisoquinolin- 1- yl}methyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCc3c(C1CN1C(=O)c4c(C1=O)cccc4)cccc3)c([nH]2)C

STK552932
Synonyms: 3- [(2- chlorobenzyl)sulfanyl]- 5- (methylsulfanyl)- 10- (propan- 2- yl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1ccccc1Cl)nn2)CC(OC3)C(C)C

STK552933
Synonyms: (5Z)- 1- [4- (butan- 2- yl)phenyl]- 5- {[1- (2- phenoxyethyl)- 1H- indol- 3- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCOc2ccccc2)/C1=O)C

STK552935
Synonyms: N~2~- (2- methoxyethyl)- N~4~- (3- methylphenyl)- 5- nitropyrimidine- 2,4,6- triamine
Smiles: COCCNc1nc(Nc2cccc(c2)C)c(c(n1)N)[N+](=O)[O-]

STK552936
Synonyms: (2E)- 3- (1,3- benzodioxol- 5- yl)- N- [(2- methoxydibenzo[b,d]furan- 3- yl)carbamothioyl]prop- 2- enamide
Smiles: COc1cc2c(cc1NC(=S)NC(=O)/C=C/c1ccc3c(c1)OCO3)oc1c2cccc1

STK552937
Synonyms: 4- {[7- (ethylamino)- 4- nitro- 2,1,3- benzoxadiazol- 5- yl]amino}- 1,5- dimethyl- 2- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: CCNc1cc(Nc2c(C)n(n(c2=O)c2ccccc2)C)c(c2c1non2)[N+](=O)[O-]

STK552938
Synonyms: (2E)- N- (3- chlorophenyl)- 2- cyano- 2- {(5E)- 5- [4- (hexyloxy)benzylidene]- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene}ethanamide
Smiles: CCCCCCOc1ccc(cc1)/C=c\1/s/c(=C(/C(=O)Nc2cccc(c2)Cl)\C#N)/n(c1=O)c1ccccc1

STK552939
Synonyms: (5Z)- 5- ({1- [2- (4- tert- butylphenoxy)ethyl]- 1H- indol- 3- yl}methylidene)- 1- (4- fluorophenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Fc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCOc2ccc(cc2)C(C)(C)C)/C1=O

STK552940
Synonyms: N- {3- [bis(2- methylpropyl)amino]- 2- hydroxypropyl}- N- (2- methoxyphenyl)benzenesulfonamide
Smiles: COc1ccccc1N(S(=O)(=O)c1ccccc1)CC(CN(CC(C)C)CC(C)C)O

STK552941
Synonyms: ethyl5,6- dimethoxy- 3- {[(4- methylpiperazin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C)cc(c(c2)OC)OC

STK552942
Synonyms: 6,6- dimethyl- 3- (4- methylphenyl)- 2- [(naphthalen- 2- ylmethyl)sulfanyl]- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Cc1ccc(cc1)n1c(SCc2ccc3c(c2)cccc3)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552943
Synonyms: 4- (4- methylpiperazin- 1- yl)- 2,2- diphenylbutanenitrile
Smiles: N#CC(c1ccccc1)(c1ccccc1)CCN1CCN(CC1)C

STK552944
Synonyms: N- (3- bromophenyl)- 4- (4- ethoxyphenyl)phthalazin- 1- amine
Smiles: CCOc1ccc(cc1)c1nnc(c2c1cccc2)Nc1cccc(c1)Br

STK552945
Synonyms: 2- [(3- fluorobenzyl)sulfanyl]- 6,6- dimethyl- 3- (4- methylphenyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Cc1ccc(cc1)n1c(SCc2cccc(c2)F)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552946
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (3- methylbutyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCC(C)C)C

STK552947
Synonyms: 3- benzyl- 2- [(3- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Cc1cccc(c1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3

STK552948
Synonyms: 2- chloro- N'- [2- (methylsulfanyl)- 6,7- dihydro- 5H- cyclopenta[4,5]thieno[2,3- d]pyrimidin- 4- yl]benzohydrazide
Smiles: CSc1nc(NNC(=O)c2ccccc2Cl)c2c(n1)sc1c2CCC1

STK552953
Synonyms: 1- {[2- (4- fluorophenyl)- 2- oxoethyl]sulfanyl}- 4- (4- methylphenyl)- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Cc1ccc(cc1)n1c(=O)c2c3CCCc3sc2n2c1nnc2SCC(=O)c1ccc(cc1)F

STK552954
Synonyms: 2- [(4- fluorobenzyl)sulfanyl]- 6- propyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CCCC1OCc2c(C1)c1c(N)nc(nc1s2)SCc1ccc(cc1)F

STK552955
Synonyms: 2- oxo- 2- [(2,4,6- trimethylphenyl)amino]ethylnaphthalen- 1- ylacetate
Smiles: O=C(Cc1cccc2c1cccc2)OCC(=O)Nc1c(C)cc(cc1C)C

STK552956
Synonyms: 8- chloro- 2,2,5- trimethyl- 10- (methylsulfanyl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CSc1nc(Cl)c2c(n1)c1c(s2)nc(c2c1CC(C)(C)OC2)C

STK552958
Synonyms: 1- (dimethylamino)- 3- (4- methylphenoxy)propan- 2- ol
Smiles: CN(CC(COc1ccc(cc1)C)O)C

STK552960
Synonyms: 2- {[2- (methylsulfanyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl]sulfanyl}acetamide
Smiles: CSc1nc(SCC(=O)N)c2c(n1)sc1c2CCCC1

STK552961
Synonyms: 1- [(2,6- dichlorobenzyl)sulfanyl]- 4- (3- methylphenyl)- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CC(C1OCc2c(C1)c1c(s2)n2c(SCc3c(Cl)cccc3Cl)nnc2n(c1=O)c1cccc(c1)C)C

STK552962
Synonyms: 6,6- dimethyl- 3- (3- methylphenyl)- 2- {[2- (4- nitrophenyl)- 2- oxoethyl]sulfanyl}- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Cc1cccc(c1)n1c(SCC(=O)c2ccc(cc2)[N+](=O)[O-])nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552963
Synonyms: 2- ethyl- 3- (2- phenylethyl)- 11- (tetrahydrofuran- 2- ylmethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCc1nc2n(CC3CCCO3)c3c(c2c(=O)n1CCc1ccccc1)nc1c(n3)cccc1

STK552966
Synonyms: 2- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCn1c(SCC(=C)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552967
Synonyms: dimethyl5- ({(Z)- 2- cyano- 2- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzene- 1,3- dicarboxylate
Smiles: N#C/C(=C/Nc1cc(cc(c1)C(=O)OC)C(=O)OC)/c1scc(n1)c1ccc(c(c1)OC)OC

STK552969
Synonyms: 3- (4- bromophenyl)- 7- phenyl- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: Brc1ccc(cc1)C1=NOC2(C1)CC(=O)N(C2=O)c1ccccc1

STK552970
Synonyms: {[2- (piperidin- 1- yl)quinolin- 3- yl]methylidene}propanedinitrile
Smiles: N#CC(=Cc1cc2ccccc2nc1N1CCCCC1)C#N

STK552971
Synonyms: N- carbamoyl- 4- ({(Z)- 2- cyano- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]ethenyl}amino)benzenesulfonamide
Smiles: N#C/C(=C/Nc1ccc(cc1)S(=O)(=O)NC(=O)N)/c1scc(n1)c1ccc(cc1Cl)Cl

STK552972
Synonyms: N- cyclopentyl- 2- imino- 1,10- dimethyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: O=C(c1cc2c(n(c1=N)C)nc1n(c2=O)cccc1C)NC1CCCC1

STK552973
Synonyms: 1- [5- (1H- benzimidazol- 2- yl)- 3- (4- methoxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 2- (piperidin- 1- yl)ethanone
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1nc2c([nH]1)cccc2)C(=O)CN1CCCCC1

STK552975
Synonyms: 4- [(4- chlorobenzyl)sulfanyl]- 6,6- dimethyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CSc1nc(SCc2ccc(cc2)Cl)c2c(n1)sc1c2CC(OC1)(C)C

STK552976
Synonyms: 3- (3- methoxyphenyl)- 2- [(2- phenylethyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: COc1cccc(c1)n1c(SCCc2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK552977
Synonyms: N,N- diethyl- 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3)CC

STK552978
Synonyms: 2- methylpropyl2- (4- chlorophenyl)- 1- oxo- 1,2,3,6,7,7a- hexahydro- 3a,6- epoxyisoindole- 7- carboxylate
Smiles: CC(COC(=O)C1C2C=CC3(C1C(=O)N(C3)c1ccc(cc1)Cl)O2)C

STK552980
Synonyms: cyclohexyl4- (4- chlorophenyl)- 3a,4,5,9b- tetrahydro- 3H- cyclopenta[c]quinoline- 8- carboxylate
Smiles: Clc1ccc(cc1)C1Nc2ccc(cc2C2C1CC=C2)C(=O)OC1CCCCC1

STK552981
Synonyms: 2- amino- 1- [2- (cyclohex- 1- en- 1- yl)ethyl]- N- (2- methoxyethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCC1=CCCCC1

STK552982
Synonyms: N- (3,4- dichlorophenyl)- 2- [4- (propan- 2- yloxy)phenyl]quinazolin- 4- amine
Smiles: CC(Oc1ccc(cc1)c1nc(Nc2ccc(c(c2)Cl)Cl)c2c(n1)cccc2)C

STK552984
Synonyms: 2- [(Z)- (5- bromo- 1- ethyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)methyl]- 6- iodo- 3- methylquinazolin- 4(3H)- one
Smiles: CCN1C(=O)/C(=C\c2nc3ccc(cc3c(=O)n2C)I)/c2c1ccc(c2)Br

STK552985
Synonyms: (2'S,3S,3'S,10b'R)- 3'- (2,2- dimethylpropanoyl)- 2'- [(3- methoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1cccc(c1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C

STK552986
Synonyms: 2- [(1,3- benzodioxol- 5- ylmethyl)amino]ethanol
Smiles: OCCNCc1ccc2c(c1)OCO2

STK552988
Synonyms: 3- bromo- 2- oxo- N- [2- (piperidin- 1- yl)ethyl]- 2H- pyran- 5- carboxamide
Smiles: O=C(c1coc(=O)c(c1)Br)NCCN1CCCCC1

STK552990
Synonyms: (8S,8aR,11aS,11bS)- 8- (2,2- dimethylpropanoyl)- 10- (4- methylphenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2c2ccccc2C=C1)C(=O)C(C)(C)C

STK552991
Synonyms: 2- {[2- (4- fluorophenyl)- 2- oxoethyl]sulfanyl}- 6,6- dimethyl- 3- (4- methylphenyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Cc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)F)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK552992
Synonyms: 1- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 4- (2- phenylethyl)- 6,7,8,9- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Brc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CCCC3

STK552994
Synonyms: (5Z)- 5- [(1- {2- [2- (butan- 2- yl)phenoxy]ethyl}- 1H- indol- 3- yl)methylidene]- 1- (furan- 2- ylmethyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CCC(c1ccccc1OCCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)Cc1ccco1)C

STK552995
Synonyms: ethyl4- (5- {(Z)- [1- (3- chloro- 4- methoxyphenyl)- 2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene]methyl}furan- 2- yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(c(c1)Cl)OC

STK552996
Synonyms: (9E)- 3- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 7- methyl- 9- (4- methylbenzylidene)- 5- (4- methylphenyl)- 6,7,8,9- tetrahydro- 5H- pyrido[4,3- d][1,3]thiazolo[3,2- a]pyrimidine
Smiles: CN1C/C(=C\c2ccc(cc2)C)/C2=C(C1)C(c1ccc(cc1)C)n1c(=N2)scc1c1ccc2c(c1)OCCO2

STK552997
Synonyms: (2'S,3S,3'S,10b'R)- 3'- (2,2- dimethylpropanoyl)- 2'- [(4- methoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C

STK552998
Synonyms: N- (3,5- dichlorophenyl)- 2- (4- propoxyphenyl)quinazolin- 4- amine
Smiles: CCCOc1ccc(cc1)c1nc(Nc2cc(Cl)cc(c2)Cl)c2c(n1)cccc2

STK552999
Synonyms: 11- (3,4- dichlorophenyl)- 10- methyl- N- (3- methylphenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1cccc(c1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(c(c1)Cl)Cl)C)c1ccccc1

STK553001
Synonyms: N- {[2- (pyrazin- 2- ylcarbonyl)hydrazinyl]carbonothioyl}pyridine- 3- carboxamide
Smiles: S=C(NC(=O)c1cccnc1)NNC(=O)c1cnccn1

STK553002
Synonyms: (1'S,2'S,3R,3a'R)- 2'- (1,3- benzodioxol- 5- ylcarbonyl)- 1'- [(3- bromo- 4- methoxyphenyl)carbonyl]- 1',2'- dihydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2c3ccccc3C=C[C@@H]2[C@]2([C@@H]1C(=O)c1ccc3c(c1)OCO3)C(=O)Nc1c2cccc1

STK553003
Synonyms: (2E)- 2- [5- (3- chloro- 4- methylbenzyl)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]- 2- cyano- N- (4- ethylphenyl)ethanamide
Smiles: N#C/C(=C/1\SC(C(=O)N1c1ccccc1)Cc1ccc(c(c1)Cl)C)/C(=O)Nc1ccc(cc1)CC

STK553004
Synonyms: N- [3- (dibenzylamino)- 2- hydroxypropyl]- N- (2- methoxyphenyl)- 4- methylbenzenesulfonamide
Smiles: COc1ccccc1N(S(=O)(=O)c1ccc(cc1)C)CC(CN(Cc1ccccc1)Cc1ccccc1)O

STK553005
Synonyms: 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N,N- dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC)CCCCC3)CCC

STK553006
Synonyms: (6aS,6bR,9aS,10R)- 10- (2,2- dimethylpropanoyl)- 8- (4- methylphenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)C(C)(C)C

STK553007
Synonyms: 3- (furan- 2- ylmethyl)- 2- {[2- oxo- 2- (piperidin- 1- yl)ethyl]sulfanyl}- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: O=C(N1CCCCC1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK553008
Synonyms: N- [3- (dibenzylamino)- 2- hydroxypropyl]- 4- methyl- N- (3- methylphenyl)benzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccc(cc1)C)c1cccc(c1)C)CN(Cc1ccccc1)Cc1ccccc1

STK553009
Synonyms: methyl2- {[(3,4- dimethoxyphenyl)carbonyl]amino}- 4- methyl- 5- phenylthiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC(=O)c2ccc(c(c2)OC)OC)sc(c1C)c1ccccc1

STK553010
Synonyms: 2- (4- chlorophenyl)- 3- [5- (naphthalen- 2- yloxy)pentyl]quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1ccc2c(c1)cccc2

STK553011
Synonyms: N- {1- (3,5- dimethylphenyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}- 4- nitrobenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(NS(=O)(=O)c2ccc(cc2)[N+](=O)[O-])n(c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK553012
Synonyms: (4aS,4bR,7aS,8R)- 6- (2- methyl- 4- nitrophenyl)- 8- [(3- nitrophenyl)carbonyl]- 7a,8- dihydro- 4aH- pyrrolo[3',4':3,4]pyrrolo[1,2- b]pyridazine- 5,7(4bH,6H)- dione
Smiles: Cc1cc(ccc1N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=CC=N1)C(=O)c1cccc(c1)[N+](=O)[O-])[N+](=O)[O-]

STK553013
Synonyms: 5- phenyl- 10- (propan- 2- yl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- c]pyrimidine
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n2c1nnn2)c1ccccc1)C

STK553014
Synonyms: 4- (3,5- dimethylpiperidin- 1- yl)- 5H- pyrimido[5,4- b]indole
Smiles: CC1CC(C)CN(C1)c1ncnc2c1[nH]c1c2cccc1

STK553015
Synonyms: 1- [(4- chlorobenzyl)sulfanyl]- 4- (4- methoxyphenyl)- 7,7- dimethyl- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CC(C)(C)OCc1s2)SCc1ccc(cc1)Cl

STK553018
Synonyms: 2- [(2- methylbenzyl)sulfanyl]- 3- (prop- 2- en- 1- yl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: C=CCn1c(SCc2ccccc2C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK553019
Synonyms: 4,6- dimethyl- 2- oxo- N- (2,2,6,6- tetramethylpiperidin- 4- yl)- 2H- pyran- 5- carboxamide
Smiles: O=c1cc(C)c(c(o1)C)C(=O)NC1CC(C)(C)NC(C1)(C)C

STK553020
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (4- methoxyphenyl)methylidene]- 5- (3- nitrophenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N

STK553021
Synonyms: N'- [11- (4- chlorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]- N,N- diethylbenzene- 1,4- diamine
Smiles: CCN(c1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)Cl)c(nn1c1ccccc1)C)CC

STK553022
Synonyms: N,N- diethyl- 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC)CCCCC3)CC

STK553025
Synonyms: 6- chloro- 2- [5- (2- chlorophenyl)- 3- phenyl- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- phenylquinazoline
Smiles: Clc1ccc2c(c1)c(nc(n2)N1N=C(CC1c1ccccc1Cl)c1ccccc1)c1ccccc1

STK553026
Synonyms: (5Z)- 5- (2,6- dichlorobenzylidene)- 3- {[(E)- (2,6- dichlorophenyl)methylidene]amino}- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\c2c(Cl)cccc2Cl)/C(=O)N1/N=C/c1c(Cl)cccc1Cl

STK553029
Synonyms: (2E)- 3- (3- nitrophenyl)- N- [1- (1- pentyl- 1H- benzimidazol- 2- yl)ethyl]prop- 2- enamide
Smiles: CCCCCn1c(nc2c1cccc2)C(NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-])C

STK553030
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (2- chlorophenyl)methylidene]- 5- (3- nitrophenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)N/N=C/c1ccccc1Cl

STK553031
Synonyms: 2- methyl- N- [3- (2- methyl- 1,3- thiazol- 4- yl)phenyl]benzamide
Smiles: Cc1scc(n1)c1cccc(c1)NC(=O)c1ccccc1C

STK553032
Synonyms: (8R,8aS,11aR)- N- (4- chlorophenyl)- 10- (4- fluorophenyl)- 9,11- dioxo- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 8- carboxamide
Smiles: Fc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1N([C@H]2C(=O)Nc2ccc(cc2)Cl)N=Cc2c1cccc2

STK553034
Synonyms: N- {3- [bis(2- methylpropyl)amino]- 2- hydroxypropyl}- 2- nitro- N- phenylbenzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1)CN(CC(C)C)CC(C)C

STK553035
Synonyms: 4- {[(2E,5Z)- 5- (3- bromo- 5- ethoxy- 4- hydroxybenzylidene)- 3- ethyl- 4- oxo- 1,3- thiazolidin- 2- ylidene]amino}benzoicacid
Smiles: CCOc1cc(/C=C/2\S/C(=N/c3ccc(cc3)C(=O)O)/N(C2=O)CC)cc(c1O)Br

STK553036
Synonyms: (5Z)- 1- (3- chloro- 4- methylphenyl)- 5- ({1- [3- (3- methylphenoxy)propyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1cccc(c1)OCCCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(c(c1)Cl)C

STK553037
Synonyms: 2- [(3- fluorobenzyl)sulfanyl]- 3- (3- methylphenyl)- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)c1cccc(c1)C)SCc1cccc(c1)F)C

STK553038
Synonyms: 2- [2- ({4- amino- 6- [(4- methoxyphenyl)amino]- 5- nitropyrimidin- 2- yl}amino)ethoxy]ethanol
Smiles: OCCOCCNc1nc(Nc2ccc(cc2)OC)c(c(n1)N)[N+](=O)[O-]

STK553039
Synonyms: 1- {[2- (4- fluorophenyl)- 2- oxoethyl]sulfanyl}- 7,7- dimethyl- 4- phenyl- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Fc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CC(OC3)(C)C

STK553040
Synonyms: 4- bromo- N'- [(E)- (3- bromo- 2- hydroxy- 6,7,8,9- tetrahydrodibenzo[b,d]furan- 1- yl)methylidene]benzohydrazide
Smiles: Brc1ccc(cc1)C(=O)N/N=C/c1c(O)c(Br)cc2c1c1CCCCc1o2

STK553042
Synonyms: 2- {[4- amino- 6- (propan- 2- yl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nc(N)c2c(n1)sc1c2CC(OC1)C(C)C

STK553043
Synonyms: 1- [(2S)- 1- hydrazinyl- 1- oxo- 3- phenylpropan- 2- yl]- 3- (4- methoxyphenyl)urea(non- preferredname)
Smiles: NNC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccc(cc1)OC

STK553045
Synonyms: (6aS,6bR,9aS,10R)- 10- (2,2- dimethylpropanoyl)- 8- (2- methyl- 4- nitrophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Cc1cc(ccc1N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)C(C)(C)C)[N+](=O)[O-]

STK553046
Synonyms: N~4~- ethyl- N~6~- (4- iodophenyl)- 7- nitro- 2,1,3- benzoxadiazole- 4,6- diamine
Smiles: CCNc1cc(Nc2ccc(cc2)I)c(c2c1non2)[N+](=O)[O-]

STK553048
Synonyms: (5Z)- 1- (3- chloro- 4- methoxyphenyl)- 5- {[1- (2,4- dichlorobenzyl)- 1H- pyrrol- 2- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1Cl)N1C(=O)NC(=O)/C(=C/c2cccn2Cc2ccc(cc2Cl)Cl)/C1=O

STK553049
Synonyms: 11- (3,4- dichlorophenyl)- N- (4- ethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(c(c2)Cl)Cl)c(nn1c1ccccc1)C

STK553051
Synonyms: (5Z)- 5- (2,5- dimethoxybenzylidene)- 3- (4- hydroxyphenyl)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1ccc(cc1/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)O)OC

STK553052
Synonyms: 4- {[7- (3- methylpiperidin- 1- yl)- 4- nitro- 2,1,3- benzoxadiazol- 5- yl]amino}phenol
Smiles: CC1CCCN(C1)c1cc(Nc2ccc(cc2)O)c(c2c1non2)[N+](=O)[O-]

STK553054
Synonyms: diethylethyl(3- {2- [(3- nitrophenyl)carbonyl]hydrazinyl}- 3- oxopropyl)propanedioate
Smiles: CCOC(=O)C(C(=O)OCC)(CCC(=O)NNC(=O)c1cccc(c1)[N+](=O)[O-])CC

STK553055
Synonyms: (9E)- 9- benzylidene- 3- (3- methoxyphenyl)- 7- methyl- 5- phenyl- 6,7,8,9- tetrahydro- 5H- pyrido[4,3- d][1,3]thiazolo[3,2- a]pyrimidine
Smiles: COc1cccc(c1)c1csc2=NC3=C(C(n12)c1ccccc1)CN(C/C/3=C\c1ccccc1)C

STK553056
Synonyms: N- [(4E)- 8- ethoxy- 6- (4- ethoxyphenyl)- 1,3- dimethyl- 4H- cyclohepta[c]furan- 4- ylidene]- N'- phenylbenzene- 1,4- diamine
Smiles: CCOc1cc(c/c(=N\c2ccc(cc2)Nc2ccccc2)/c2c1c(C)oc2C)c1ccc(cc1)OCC

STK553059
Synonyms: (6aR,6bS,9aR,10S)- 8- (2- methoxyphenyl)- N- (4- nitrophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: COc1ccccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK553061
Synonyms: N- [3- (dibenzylamino)- 2- hydroxypropyl]- 4- methyl- N- (3- nitrophenyl)benzenesulfonamide
Smiles: OC(CN(S(=O)(=O)c1ccc(cc1)C)c1cccc(c1)[N+](=O)[O-])CN(Cc1ccccc1)Cc1ccccc1

STK553062
Synonyms: 2- [(Z)- (5- bromo- 2- oxo- 1- propyl- 1,2- dihydro- 3H- indol- 3- ylidene)methyl]- 3- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: CCCN1C(=O)/C(=C\c2nc3ccccc3c(=O)n2c2ccc(cc2)Cl)/c2c1ccc(c2)Br

STK553064
Synonyms: 11- (3,4- dichlorophenyl)- 10- methyl- 8- phenyl- N- [3- (trifluoromethyl)phenyl]- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1nn(c2c1C(c1ccc(c(c1)Cl)Cl)n1c(=N2)c(Nc2cccc(c2)C(F)(F)F)nc2c1cccc2)c1ccccc1

STK553065
Synonyms: 2- imino- 1- (4- methoxybenzyl)- 10- methyl- 3- [(4- methylphenyl)sulfonyl]- 1,2- dihydro- 5H- dipyrido[1,2- a:2',3'- d]pyrimidin- 5- one
Smiles: COc1ccc(cc1)Cn1c2nc3c(C)cccn3c(=O)c2cc(c1=N)S(=O)(=O)c1ccc(cc1)C

STK553066
Synonyms: 1- (4- nitrophenyl)- 4- (2,3,5,6- tetrafluoropyridin- 4- yl)piperazine
Smiles: [O-][N+](=O)c1ccc(cc1)N1CCN(CC1)c1c(F)c(F)nc(c1F)F

STK553068
Synonyms: (2'R,3'R)- 3'- [(4- chlorophenyl)carbonyl]- 2'- (furan- 2- yl)- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1ccco1)C(=O)c1c(C2=O)cccc1)cccc3