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

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STK547701
Synonyms: 5- [(4- ethoxyphenyl)amino]- 2- ethyl- 5- oxopentanoicacid
Smiles: CCOc1ccc(cc1)NC(=O)CCC(C(=O)O)CC

STK547702
Synonyms: 3- hydroxy- 4- [(4- methylphenyl)carbonyl]- 5- (2- nitrophenyl)- 1- [3- (trifluoromethyl)phenyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1[N+](=O)[O-])c1cccc(c1)C(F)(F)F

STK547703
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [4- (2,4- dinitrophenoxy)- 3- methoxyphenyl]methylidene}- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

STK547704
Synonyms: 1- benzyl- N- (furan- 2- ylmethyl)- 2- imino- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: O=C(c1cc2c(n(c1=N)Cc1ccccc1)nc1n(c2=O)cccc1)NCc1ccco1

STK547705
Synonyms: methyl3,3,3- trifluoro- N- (furan- 2- ylcarbonyl)- 2- [(4- methyl- 1,3- benzothiazol- 2- yl)amino]alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccco1)Nc1nc2c(s1)cccc2C

STK547706
Synonyms: 2- [(3- benzyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N- (2,4- dimethylphenyl)acetamide
Smiles: Cc1ccc(c(c1)C)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3

STK547707
Synonyms: 2- {[6- amino- 3,5- dicyano- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (3- ethoxyphenyl)acetamide
Smiles: CCOc1cccc(c1)NC(=O)CSc1nc(N)c(c(c1C#N)c1cccs1)C#N

STK547709
Synonyms: methyl4- [({[4- (4- chlorophenyl)- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1

STK547710
Synonyms: 8- {[benzyl(methyl)amino]methyl}- 3- (4- chlorophenyl)- 7- hydroxy- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CN(Cc1c(O)ccc2c1oc(c(c2=O)c1ccc(cc1)Cl)C(F)(F)F)Cc1ccccc1

STK547711
Synonyms: 3- [3- (2- bromophenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccccc1Br

STK547712
Synonyms: 2- ({5- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)- N- (2,4,6- trimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(s1)SCc1cccc2c1cccc2

STK547713
Synonyms: N- (12- cyanoindolizino[2,3- b]quinoxalin- 3- yl)- 4- methoxybenzamide
Smiles: N#Cc1c2ccc(cn2c2c1nc1ccccc1n2)NC(=O)c1ccc(cc1)OC

STK547714
Synonyms: 4- acetyl- 3- hydroxy- 1- (4- hydroxyphenyl)- 5- [4- (propan- 2- yl)phenyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Oc1ccc(cc1)N1C(c2ccc(cc2)C(C)C)C(=C(C1=O)O)C(=O)C

STK547715
Synonyms: butyl2- amino- 1- (2- methoxybenzyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1OC

STK547716
Synonyms: (8S,8aR,11aS)- 10- (4- butoxyphenyl)- 8- [(4- chlorophenyl)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)Cl

STK547717
Synonyms: 3- (2,5- dimethoxyphenyl)- 5- imino- 1,7- dimethyl- 2,6- dioxabicyclo[2.2.2]octane- 4,8,8- tricarbonitrile
Smiles: N#CC12C(=N)OC(OC1c1cc(OC)ccc1OC)(C(C2(C#N)C#N)C)C

STK547718
Synonyms: methyl6- amino- 5- cyano- 2- {[(3- cyano- 6,7,8,9- tetrahydro- 5H- cyclohepta[b]pyridin- 2- yl)sulfanyl]methyl}- 4- [2- (trifluoromethyl)phenyl]- 4H- pyran- 3- carboxylate
Smiles: COC(=O)C1=C(CSc2nc3CCCCCc3cc2C#N)OC(=C(C1c1ccccc1C(F)(F)F)C#N)N

STK547719
Synonyms: 2- amino- 1- (2- methoxybenzyl)- N- phenyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccccc1Cn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1ccccc1

STK547720
Synonyms: 2- imino- 10- (1- methyl- 1H- indol- 3- yl)tetrahydro- 8a,3- (epoxymethano)chromene- 3,4,4(2H,4aH)- tricarbonitrile
Smiles: N#CC12C(=N)OC3(OC1c1cn(c4c1cccc4)C)C(C2(C#N)C#N)CCCC3

STK547722
Synonyms: 1- benzyl- N- ethyl- 2- imino- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: CCNC(=O)c1cc2c(n(c1=N)Cc1ccccc1)nc1n(c2=O)cccc1

STK547723
Synonyms: 3- cyclohexyl- 2- [(2- oxo- 2- phenylethyl)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)C1CCCCC1)SCC(=O)c1ccccc1)C

STK547724
Synonyms: 1- butyl- 5- (3- fluorophenyl)- 3- hydroxy- 4- [(4- methoxyphenyl)carbonyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CCCCN1C(c2cccc(c2)F)C(=C(C1=O)O)C(=O)c1ccc(cc1)OC

STK547725
Synonyms: ethyl4- ({[2- amino- 1- (2- methoxybenzyl)- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1OC

STK547726
Synonyms: ethyl2- imino- 1- (4- methoxybenzyl)- 10- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxylate
Smiles: CCOC(=O)c1cc2c(n(c1=N)Cc1ccc(cc1)OC)nc1n(c2=O)cccc1C

STK547727
Synonyms: 5- (3,4- dimethoxyphenyl)- 3- hydroxy- 1- (4- methylphenyl)- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1cc(ccc1OC)C1N(c2ccc(cc2)C)C(=O)C(=C1C(=O)c1ccccc1)O

STK547728
Synonyms: 4- amino- N'- [(E)- {3- [(2- fluorobenzyl)oxy]phenyl}methylidene]- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: Fc1ccccc1COc1cccc(c1)/C=N/N=C(/c1nonc1N)\N

STK547729
Synonyms: N,N'- bis[3- (dimethylamino)propyl]- 9- oxo- 9H- fluorene- 2,7- disulfonamide
Smiles: CN(CCCNS(=O)(=O)c1ccc2c(c1)C(=O)c1c2ccc(c1)S(=O)(=O)NCCCN(C)C)C

STK547730
Synonyms: [3- (3- {[(4- chlorophenyl)carbonyl]amino}pyridinium- 1- yl)quinoxalin- 2- yl][(4- methylphenyl)sulfonyl]azanide
Smiles: Cc1ccc(cc1)S(=O)(=O)[N-]c1nc2ccccc2nc1[n+]1cccc(c1)NC(=O)c1ccc(cc1)Cl

STK547731
Synonyms: 1- benzyl- 3- hydroxy- 5- phenyl- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: O=C(C1=C(O)C(=O)N(C1c1ccccc1)Cc1ccccc1)c1ccccc1

STK547732
Synonyms: 3- (4- chlorophenyl)- 7- hydroxy- 8- [(2- methylpiperidin- 1- yl)methyl]- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: Clc1ccc(cc1)c1c(=O)c2ccc(c(c2oc1C(F)(F)F)CN1CCCCC1C)O

STK547733
Synonyms: 3,5- bis(4- methoxyphenyl)- 2,3a- diphenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: COc1ccc(cc1)N1C(=O)C2C(C1=O)(c1ccccc1)C(N(O2)c1ccccc1)c1ccc(cc1)OC

STK547734
Synonyms: (8S,8aR,11aS)- 8- [(3- nitrophenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: O=C1NC(=O)[C@H]2[C@@H]1[C@@H](C(=O)c1cccc(c1)[N+](=O)[O-])N1C2c2ccccc2C=C1

STK547736
Synonyms: 1- oxo- 1- phenylbutan- 2- yl2- (4- methoxyphenyl)quinoline- 4- carboxylate
Smiles: CCC(C(=O)c1ccccc1)OC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)OC

STK547738
Synonyms: (3S)- 2- (3,4- difluorophenyl)- 3- (tricyclo[3.3.1.1~3,7~]dec- 1- ylcarbonyl)cyclopropane- 1,1- dicarbonitrile
Smiles: N#CC1(C#N)C([C@@H]1C(=O)C12CC3CC(C2)CC(C1)C3)c1ccc(c(c1)F)F

STK547740
Synonyms: 2- [(4- amino- 7- methyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc(N)c2c(n1)sc1c2CCC(C1)C

STK547741
Synonyms: 4- [(1,3- benzodioxol- 5- ylmethyl)sulfanyl]- 6,6- dimethyl- 2- phenyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CC1(C)OCc2c(C1)c1c(SCc3ccc4c(c3)OCO4)nc(nc1s2)c1ccccc1

STK547742
Synonyms: 1- (4- fluorophenyl)- 3- hydroxy- 5- (2- nitrophenyl)- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Fc1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1[N+](=O)[O-])C(=O)c1ccccc1)O

STK547745
Synonyms: diphenylmethyl(6aS,6bR,9aS,10R)- 8- [2- (methoxycarbonyl)phenyl]- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxylate
Smiles: COC(=O)c1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)OC(c1ccccc1)c1ccccc1

STK547747
Synonyms: N- (3,5- dimethylphenyl)- 10- methyl- 11- (3- nitrophenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1cc(cc(c1)C)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cccc(c1)[N+](=O)[O-])C)c1ccccc1

STK547748
Synonyms: 4- [(4- bromophenyl)carbonyl]- 3- hydroxy- 5- (4- nitrophenyl)- 1- (prop- 2- en- 1- yl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: C=CCN1C(c2ccc(cc2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)c1ccc(cc1)Br

STK547750
Synonyms: 1- [1- (1H- benzimidazol- 2- yl)- 3- (methylsulfanyl)propyl]- 3- (3- chlorophenyl)urea
Smiles: CSCCC(c1nc2c([nH]1)cccc2)NC(=O)Nc1cccc(c1)Cl

STK547751
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 11- (4- ethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccc(c(c1)Cl)OC)nc1c2cccc1

STK547752
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- cyclohexylmethylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1c1ccccc1)c1nonc1N)N/N=C/C1CCCCC1

STK547753
Synonyms: (3aR,4S,9aR,9bS)- 4- [(4- chlorophenyl)carbonyl]- 8- (phenylcarbonyl)- 2- [2- (trifluoromethyl)phenyl]- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1C(F)(F)F)C(=O)c1ccccc1

STK547754
Synonyms: ethyl2- [({[3- cyano- 6- (thiophen- 2- yl)- 4- (trifluoromethyl)pyridin- 2- yl]sulfanyl}acetyl)amino]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc(cc(c2C#N)C(F)(F)F)c2cccs2)sc2c1CCCC2

STK547755
Synonyms: 2- {[3- cyclohexyl- 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}- N- phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CC(OC3)C(C)C

STK547756
Synonyms: N- {1- (3- butoxypropyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}- 4- methylbenzenesulfonamide
Smiles: CCCCOCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)C)S(=O)(=O)c1ccc(cc1)C

STK547757
Synonyms: (4Z)- 2- (2- chloro- 5- nitrophenyl)- 4- ({5- [3- (trifluoromethyl)phenyl]furan- 2- yl}methylidene)- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C\c1ccc(o1)c1cccc(c1)C(F)(F)F)c1cc(ccc1Cl)[N+](=O)[O-]

STK547758
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (morpholin- 4- ylmethyl)- N'- {(E)- [4- (propan- 2- yl)phenyl]methylidene}- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCOCC1)c1nonc1N)N/N=C/c1ccc(cc1)C(C)C

STK547759
Synonyms: 3- bromo- 2- oxo- N- (2,2,6,6- tetramethylpiperidin- 4- yl)- 2H- pyran- 5- carboxamide
Smiles: O=C(c1coc(=O)c(c1)Br)NC1CC(C)(C)NC(C1)(C)C

STK547761
Synonyms: methyl3- {[3- (4- benzylpiperidin- 1- yl)propanoyl]amino}- 5- chloro- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCC(CC1)Cc1ccccc1)cc(cc2)Cl

STK547762
Synonyms: 6- chloro- N- [(9,10- dioxo- 9,10- dihydroanthracen- 2- yl)carbamothioyl]pyridine- 3- carboxamide
Smiles: S=C(NC(=O)c1ccc(nc1)Cl)Nc1ccc2c(c1)C(=O)c1c(C2=O)cccc1

STK547763
Synonyms: 2- {(5Z)- 5- [4- (octyloxy)benzylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}butanoicacid
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)C(C(=O)O)CC

STK547764
Synonyms: (8S,8aR,11aS)- 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]isoquinoline- 8- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)Cl)cccc3

STK547765
Synonyms: (6aS,6bR,9aS,10R)- 10- (1H- benzotriazol- 1- ylcarbonyl)- 8- (4- chlorophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Clc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)n1nnc2c1cccc2

STK547766
Synonyms: (3E)- 3- benzylidene- 1- (4- propoxyphenyl)pyrrolidine- 2,5- dione
Smiles: CCCOc1ccc(cc1)N1C(=O)C/C(=C\c2ccccc2)/C1=O

STK547768
Synonyms: ethyl2- imino- 1- (4- methoxybenzyl)- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxylate
Smiles: CCOC(=O)c1cc2c(n(c1=N)Cc1ccc(cc1)OC)nc1n(c2=O)cccc1

STK547769
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(1E)- 1- {4- [(2- chlorobenzyl)oxy]phenyl}ethylidene]- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: C/C(=N\NC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)/c1ccc(cc1)OCc1ccccc1Cl

STK547770
Synonyms: 4- (decyloxy)- N- [(E)- {4- [(4- methyl- 3,6- dihydro- 2H- pyran- 3- yl)oxy]phenyl}methylidene]aniline
Smiles: CCCCCCCCCCOc1ccc(cc1)/N=C/c1ccc(cc1)OC1COCC=C1C

STK547772
Synonyms: (3- amino- 6,7,8,9- tetrahydro- 5H- cyclohepta[b]thieno[3,2- e]pyridin- 2- yl)(4- methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)c1sc2c(c1N)cc1c(n2)CCCCC1

STK547773
Synonyms: 2- [(2- methoxyphenyl)amino]- 2- oxoethylN'- cyano- N- propan- 2- ylcarbamimidothioate
Smiles: N#C/N=C(\NC(C)C)/SCC(=O)Nc1ccccc1OC

STK547774
Synonyms: 4- (benzylsulfanyl)- 6,6- dimethyl- 2- phenyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CC1(C)OCc2c(C1)c1c(SCc3ccccc3)nc(nc1s2)c1ccccc1

STK547775
Synonyms: ethyl8- (2,5- dimethylphenyl)- 1- (3- nitrophenyl)- 6- phenyl- 4- thia- 1,2,6,7- tetraazaspiro[4.5]deca- 2,7- diene- 3- carboxylate
Smiles: CCOC(=O)C1=NN(C2(S1)CCC(=NN2c1ccccc1)c1cc(C)ccc1C)c1cccc(c1)[N+](=O)[O-]

STK547777
Synonyms: 2- imino- N- (2- methoxyethyl)- 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(cc2c1nc1ccccn1c2=O)C(=O)NCCOC

STK547778
Synonyms: 2- (4- chlorophenyl)- 3- {6- [2- methoxy- 4- (prop- 2- en- 1- yl)phenoxy]hexyl}quinazolin- 4(3H)- one
Smiles: C=CCc1ccc(c(c1)OC)OCCCCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK547779
Synonyms: methyl5- chloro- 3- {[3- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCC3(CC1)OCCO3)cc(cc2)Cl

STK547780
Synonyms: N'~1~- [(3E)- 1- butyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]- N'~7~- [(3Z)- 1- butyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]heptanedihydrazide
Smiles: CCCCN1C(=O)/C(=N/NC(=O)CCCCCC(=O)N/N=C\2/c3ccccc3N(C2=O)CCCC)/c2c1cccc2

STK547781
Synonyms: 4- [(8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 9,11- dioxo- 8a,9,11a,11b- tetrahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinolin- 10(11H)- yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccc(cc2)Cl)C=Cc2c1cccc2

STK547782
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- N'- {(1E)- 1- [3- (2H- tetrazol- 2- yl)phenyl]ethylidene}- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)N/N=C(/c1cccc(c1)n1nncn1)\C

STK547783
Synonyms: 2- {[5- (4- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,4- dimethoxyphenyl)acetamide
Smiles: COc1ccc(cc1OC)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)Cl

STK547784
Synonyms: 2- [(2- ethyl- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]- N- (4- methylphenyl)acetamide
Smiles: CCc1nc(SCC(=O)Nc2ccc(cc2)C)c2c(n1)sc1c2CC(OC1)(C)C

STK547785
Synonyms: [1- {bis[2- (hydroxy- kappaO)ethyl]amino- kappaN}- 3- (2- methylphenoxy)propan- 2- olato(3- )- kappaO]boron
Smiles: Cc1ccccc1OCC1C[N+]23[B-](O1)(OCC3)OCC2

STK547786
Synonyms: (2'R,3'R)- 2'- (4- nitrophenyl)- 3'- (phenylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: O=C([C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1ccc(cc1)[N+](=O)[O-])C(=O)c1c(C2=O)cccc1)cccc3)c1ccccc1

STK547788
Synonyms: 3- [(Z)- {3- [2- (3,4- dimethoxyphenyl)ethyl]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene}methyl]- 2- (dimethylamino)- 9- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: COc1cc(CCN2C(=S)S/C(=C\c3c(nc4n(c3=O)cccc4C)N(C)C)/C2=O)ccc1OC

STK547789
Synonyms: [(4- bromophenyl)sulfonyl][1,4- dioxo- 3- (1- pentyl- 1H- imidazol- 3- ium- 3- yl)- 1,4- dihydronaphthalen- 2- yl]azanide
Smiles: CCCCCn1cc[n+](c1)C1=C([N-]S(=O)(=O)c2ccc(cc2)Br)C(=O)c2c(C1=O)cccc2

STK547790
Synonyms: 2- [(2- butyl- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]- N- (2- chlorophenyl)acetamide
Smiles: CCCCc1nc(SCC(=O)Nc2ccccc2Cl)c2c(n1)sc1c2CC(OC1)(C)C

STK547791
Synonyms: ethyl4- {3- hydroxy- 4- [(4- methoxyphenyl)carbonyl]- 5- (3- nitrophenyl)- 2- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)c1ccc(cc1)OC)O

STK547792
Synonyms: 4- (naphthalen- 1- yl)- 5- [5- (thiophen- 3- yl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazole- 3- thiol
Smiles: Sc1nnc(n1c1cccc2c1cccc2)c1n[nH]c(c1)c1cscc1

STK547793
Synonyms: 2- [(4- oxo- 3- propyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)N)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547794
Synonyms: [3- amino- 6- phenyl- 4- (trifluoromethyl)thieno[2,3- b]pyridin- 2- yl](3,4- dimethoxyphenyl)methanone
Smiles: COc1cc(ccc1OC)C(=O)c1sc2c(c1N)c(cc(n2)c1ccccc1)C(F)(F)F

STK547795
Synonyms: ethyl1- benzyl- 2- {[(2- chlorophenyl)carbonyl]amino}- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccccc2Cl)n(c2c1nc1ccccc1n2)Cc1ccccc1

STK547797
Synonyms: ethyl(1R,2R,3S,3aS)- 1- [(3- bromo- 4- methoxyphenyl)carbonyl]- 2- (4- bromophenyl)- 3- cyano- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinoline- 3- carboxylate
Smiles: CCOC(=O)[C@@]1(C#N)[C@@H](c2ccc(cc2)Br)[C@@H](N2[C@H]1C=Cc1c2cccc1)C(=O)c1ccc(c(c1)Br)OC

STK547798
Synonyms: ethyl6- bromo- 2- [(diethylamino)methyl]- 5- hydroxy- 1- phenyl- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(O)c(cc2n(c1CN(CC)CC)c1ccccc1)Br

STK547799
Synonyms: ethyl4- [4- oxo- 11- (2- phenylethyl)- 4,11- dihydro- 3H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 3- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1cnc2c(c1=O)c1nc3ccccc3nc1n2CCc1ccccc1

STK547800
Synonyms: 2- [(2- ethyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)sulfanyl]- N- (4- methoxyphenyl)acetamide
Smiles: CCc1nc(SCC(=O)Nc2ccc(cc2)OC)c2c(n1)sc1c2CCCC1

STK547801
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (2- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccccc1)C

STK547802
Synonyms: 1,1'- ethyne- 1,2- diylbis[4- (prop- 1- yn- 1- yl)benzene]
Smiles: CC#Cc1ccc(cc1)C#Cc1ccc(cc1)C#CC

STK547803
Synonyms: 4- [(E)- 2- (1- butyl- 1H- benzimidazol- 2- yl)ethenyl]- N,N- dimethylaniline
Smiles: CCCCn1c(/C=C/c2ccc(cc2)N(C)C)nc2c1cccc2

STK547804
Synonyms: (5Z)- 3- (3- bromophenyl)- 5- [4- (octyloxy)benzylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)c1cccc(c1)Br

STK547805
Synonyms: 3- fluorobenzylN'- cyano- N- (3- fluorophenyl)carbamimidothioate
Smiles: N#C/N=C(/Nc1cccc(c1)F)\SCc1cccc(c1)F

STK547806
Synonyms: 2- {[3- cyano- 4- (4- methoxyphenyl)- 6- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (4- fluorophenyl)acetamide
Smiles: COc1ccc(cc1)c1cc(nc(c1C#N)SCC(=O)Nc1ccc(cc1)F)c1cccs1

STK547807
Synonyms: 2- [(3- methylbutyl)sulfanyl]- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCn1c(SCCC(C)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547808
Synonyms: 8- {2- [(1,3- dimethyl- 4,6- dioxo- 2- thioxotetrahydropyrimidin- 5(2H)- ylidene)methyl]hydrazinyl}- 1,3,7- trimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: S=C1N(C)C(=O)C(=CNNc2nc3c(n2C)c(=O)n(c(=O)n3C)C)C(=O)N1C

STK547809
Synonyms: 4- amino- N'- [(E)- {3- bromo- 4- [(4- chlorobenzyl)oxy]- 5- ethoxyphenyl}methylidene]- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: CCOc1cc(/C=N/N=C(\c2nonc2N)/N)cc(c1OCc1ccc(cc1)Cl)Br

STK547810
Synonyms: 3- [3- (2- bromo- 4,6- dimethylphenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(C)cc(cc1Br)C

STK547811
Synonyms: 2- amino- N- hexyl- 1- [2- (4- methoxyphenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(cc1)OC

STK547812
Synonyms: 5- (2- chlorophenyl)- 3- hydroxy- 4- (phenylcarbonyl)- 1- (2- phenylethyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: O=C(C1=C(O)C(=O)N(C1c1ccccc1Cl)CCc1ccccc1)c1ccccc1

STK547814
Synonyms: 3- [(Z)- (3- hexyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 2- [4- (2- hydroxyethyl)piperazin- 1- yl]- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)CCO)/C1=O

STK547815
Synonyms: methyl4- {(E)- [2- ({1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(4,5- dihydro- 1,3- thiazol- 2- ylsulfanyl)methyl]- 1H- 1,2,3- triazol- 4- yl}carbonyl)hydrazinylidene]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/NC(=O)c1nnn(c1CSC1=NCCS1)c1nonc1N

STK547816
Synonyms: 2- (4- methoxyphenyl)- 3- [2- (4- nitrophenoxy)ethyl]quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(cc1)[N+](=O)[O-]

STK547818
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- N'- [(E)- naphthalen- 1- ylmethylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)N/N=C/c1cccc2c1cccc2

STK547819
Synonyms: diphenylmethyl(6aS,6bR,9aS,10R)- 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- carboxylate
Smiles: O=C([C@@H]1N2c3ccccc3C=C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1C(F)(F)F)OC(c1ccccc1)c1ccccc1

STK547820
Synonyms: 11- (3,4- dimethoxyphenyl)- 3- (3,5- dimethylphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1cc(ccc1OC)n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK547821
Synonyms: 3- [2- (2- ethylphenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: CCc1ccccc1OCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STK547822
Synonyms: 2- (4- methoxyphenyl)- 3- [3- (2,3,6- trimethylphenoxy)propyl]quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(C)ccc(c1C)C

STK547823
Synonyms: N'~1~- [(3Z)- 5- methoxy- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]- N'~6~- [(3Z)- 6- methoxy- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]hexanedihydrazide
Smiles: COc1ccc2c(c1)NC(=O)/C/2=N\NC(=O)CCCCC(=O)N/N=C/1\C(=O)Nc2c1cc(OC)cc2

STK547824
Synonyms: (5E)- 2- [4- (3- methylphenyl)piperazin- 1- yl]- 5- {2- [(4- nitrobenzyl)oxy]benzylidene}- 1,3- thiazol- 4(5H)- one
Smiles: Cc1cccc(c1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccccc2OCc2ccc(cc2)[N+](=O)[O-])/S1

STK547825
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 11- (3,4- dimethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(cc1Cl)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(c(c1)OC)OC)C)c1ccccc1

STK547826
Synonyms: N- {2- [(3- cyano- 4- ethyl- 5- methylthiophen- 2- yl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}- 2- phenylacetamide
Smiles: N#Cc1c(sc(c1CC)C)NC(C(F)(F)F)(C(F)(F)F)NC(=O)Cc1ccccc1

STK547828
Synonyms: N,N- diethyl- 2- [4- (4- {[4- methoxy- 3- (piperidin- 1- ylcarbonyl)phenyl]amino}phthalazin- 1- yl)phenoxy]acetamide
Smiles: CCN(C(=O)COc1ccc(cc1)c1nnc(c2c1cccc2)Nc1ccc(c(c1)C(=O)N1CCCCC1)OC)CC

STK547829
Synonyms: 4- [(2E)- 2- benzylidenehydrazinyl]- 2- (pyridin- 3- yl)quinazoline
Smiles: c1ccc(cc1)/C=N/Nc1nc(nc2c1cccc2)c1cccnc1

STK547830
Synonyms: N- (2- methoxyphenyl)- 2- [(4- oxo- 3- propyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)Nc2ccccc2OC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547832
Synonyms: 2- {[3- (2- methylphenyl)- 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)n1c1ccccc1C)CCCC3

STK547833
Synonyms: (8S,8aR,11aS)- 10- (2,4- dimethylphenyl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1C)C)cccc3

STK547834
Synonyms: 2- (benzylamino)- 2- oxoethylN'- cyano- N- prop- 2- en- 1- ylcarbamimidothioate
Smiles: C=CCN/C(=N/C#N)/SCC(=O)NCc1ccccc1

STK547838
Synonyms: 3- (3,4- dichlorophenyl)- 11- (4- methylphenyl)- 10- (phenylcarbonyl)- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: Cc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccc(c(c2)Cl)Cl)Nc2c(N1C(=O)c1ccccc1)cccc2

STK547840
Synonyms: N- (diphenylmethyl)- 2- {[3- (3- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCCC3

STK547841
Synonyms: [3- (4- {[(2- chlorophenyl)carbonyl]amino}pyridinium- 1- yl)quinoxalin- 2- yl][(4- chlorophenyl)sulfonyl]azanide
Smiles: Clc1ccc(cc1)S(=O)(=O)[N-]c1nc2ccccc2nc1[n+]1ccc(cc1)NC(=O)c1ccccc1Cl

STK547842
Synonyms: 2- [(5- ethyl- 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: CCc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)C)nn2)CCCC3

STK547843
Synonyms: 2- [(5- phenyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]- 1- (piperidin- 1- yl)ethanone
Smiles: O=C(N1CCCCC1)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1

STK547844
Synonyms: 3- {[benzyl(ethyl)amino]methyl}- 6- ethyl- 2- methylquinolin- 4- ol
Smiles: CCN(Cc1c(C)nc2c(c1O)cc(cc2)CC)Cc1ccccc1

STK547845
Synonyms: 2- methoxyethyl2- amino- 1- (4- hydroxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)O

STK547846
Synonyms: ethyl5- methoxy- 3- {[3- methyl- 4- (3- methylphenyl)butanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CC(Cc1cccc(c1)C)C)cc(cc2)OC

STK547849
Synonyms: methyl4- [3- (4- tert- butylphenyl)- 1- oxo- 10- propanoyl- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 11- yl]benzoate
Smiles: CCC(=O)N1c2ccccc2NC2=C(C1c1ccc(cc1)C(=O)OC)C(=O)CC(C2)c1ccc(cc1)C(C)(C)C

STK547850
Synonyms: 2- (3- bromo- 2,8- dimethyl- 4- oxoquinolin- 1(4H)- yl)- N- (3- methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)Cn1c(C)c(Br)c(=O)c2c1c(C)ccc2

STK547851
Synonyms: 2- (4- chlorophenyl)- 3- [3- (2,4,6- trimethylphenoxy)propyl]quinazolin- 4(3H)- one
Smiles: Cc1cc(C)c(c(c1)C)OCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK547852
Synonyms: ethyl4- [(4- fluorophenyl)amino]- 2- methylquinoline- 6- carboxylate
Smiles: CCOC(=O)c1ccc2c(c1)c(Nc1ccc(cc1)F)cc(n2)C

STK547853
Synonyms: 3- {[2- (3- methylphenyl)quinazolin- 4- yl]amino}benzoicacid
Smiles: Cc1cccc(c1)c1nc(Nc2cccc(c2)C(=O)O)c2c(n1)cccc2

STK547855
Synonyms: 2- [(4- amino- 7- methyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- phenylacetamide
Smiles: CC1CCc2c(C1)sc1c2c(N)nc(n1)SCC(=O)Nc1ccccc1

STK547856
Synonyms: octyl3- (6- methyl- 4- oxo- 2- thioxo- 1,2,3,4- tetrahydropyrimidin- 5- yl)propanoate
Smiles: CCCCCCCCOC(=O)CCc1c(C)[nH]c(=S)[nH]c1=O

STK547857
Synonyms: N- (4- bromophenyl)- 2- [(6,6- dimethyl- 2- phenyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nc(nc2c1c1CC(C)(C)OCc1s2)c1ccccc1

STK547858
Synonyms: ethyl4- {2- (3- fluorophenyl)- 4- hydroxy- 3- [(4- methoxyphenyl)carbonyl]- 5- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C(=C(C1c1cccc(c1)F)C(=O)c1ccc(cc1)OC)O

STK547860
Synonyms: (4Z)- 4- (4- ethoxy- 3,5- diiodobenzylidene)- 2- (furan- 2- yl)- 1,3- oxazol- 5(4H)- one
Smiles: CCOc1c(I)cc(cc1I)/C=C/1\N=C(OC1=O)c1ccco1

STK547861
Synonyms: propan- 2- yl2- amino- 1- (tetrahydrofuran- 2- ylmethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)CC1CCCO1)C

STK547862
Synonyms: 2- amino- 1- (3,5- dichlorophenyl)- N- (1- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Clc1cc(Cl)cc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NC(c1ccccc1)C

STK547863
Synonyms: 4- acetyl- 3- hydroxy- 1- [3- (morpholin- 4- yl)propyl]- 5- (2- nitrophenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1ccccc1[N+](=O)[O-])CCCN1CCOCC1

STK547864
Synonyms: (6aS,6bR,9aS,10R)- 10- [(3- bromo- 4- methoxyphenyl)carbonyl]- 8- (4- fluorophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)F)C=Cc1c2cccc1

STK547865
Synonyms: 2- [(6- iodo- 4- oxo- 3- phenyl- 3,4- dihydroquinazolin- 2- yl)sulfanyl]- N- (2- methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2ccc(cc2c(=O)n1c1ccccc1)I

STK547866
Synonyms: 2- amino- 1- (3,5- dimethylphenyl)- N- (1- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Cc1cc(C)cc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NC(c1ccccc1)C

STK547867
Synonyms: 1- benzyl- 2- imino- 10- methyl- 5- oxo- N- (tetrahydrofuran- 2- ylmethyl)- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: O=C(c1cc2c(n(c1=N)Cc1ccccc1)nc1n(c2=O)cccc1C)NCC1CCCO1

STK547868
Synonyms: (2Z)- 3- (5- methylfuran- 2- yl)- 2- {[(4- methylphenyl)carbonyl]amino}prop- 2- enoicacid
Smiles: Cc1ccc(cc1)C(=O)N/C(=C\c1ccc(o1)C)/C(=O)O

STK547869
Synonyms: N- [1- (1H- benzimidazol- 2- yl)- 3- (methylsulfanyl)propyl]- 2- methylbenzamide
Smiles: CSCCC(c1nc2c([nH]1)cccc2)NC(=O)c1ccccc1C

STK547870
Synonyms: (3aR,4S,9aR,9bS)- 4- [(4- chlorophenyl)carbonyl]- 2- (3- fluorophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Fc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccc(cc2)Cl)C=CC(=C1)C(=O)c1ccccc1

STK547871
Synonyms: 2- {[3- cyano- 6- (4- methoxyphenyl)- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (4- methoxybenzyl)acetamide
Smiles: COc1ccc(cc1)CNC(=O)CSc1nc(cc(c1C#N)c1cccs1)c1ccc(cc1)OC

STK547872
Synonyms: methyl(1R,2R,3R,3aS)- 3- cyano- 2- (4- nitrophenyl)- 1- (phenylcarbonyl)- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinoline- 3- carboxylate
Smiles: COC(=O)[C@]1(C#N)[C@@H](c2ccc(cc2)[N+](=O)[O-])[C@@H](N2[C@H]1C=Cc1c2cccc1)C(=O)c1ccccc1

STK547873
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 5- [(4- methylbenzyl)sulfanyl]- 1,3,4- thiadiazole
Smiles: Cc1ccc(cc1)CSc1nnc(s1)SCc1ccc(cc1)Cl

STK547874
Synonyms: 3- (3,5- dimethylphenyl)- 11- (4- ethoxyphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCOc1ccc(cc1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)c1cc(C)cc(c1)C

STK547875
Synonyms: 2- (2- amino- 3- cyano- 1H- pyrrolo[2,3- b]quinoxalin- 1- yl)ethyl3- nitrobenzoate
Smiles: N#Cc1c(N)n(c2c1nc1ccccc1n2)CCOC(=O)c1cccc(c1)[N+](=O)[O-]

STK547876
Synonyms: (3aR,4S,9aR,9bS)- 2- (4- acetylphenyl)- 4- [(4- chlorophenyl)carbonyl]- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)C(=O)C)C(=O)c1ccccc1

STK547877
Synonyms: butyl2- amino- 1- (3,5- dichlorophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(Cl)cc(c1)Cl

STK547878
Synonyms: N- (2- {(2Z)- 2- [1- (3,4- dichlorophenyl)ethylidene]hydrazinyl}- 2- oxoethyl)- 3- phenylpropanamide(non- preferredname)
Smiles: O=C(N/N=C(\c1ccc(c(c1)Cl)Cl)/C)CNC(=O)CCc1ccccc1

STK547879
Synonyms: 3- (naphthalen- 2- ylamino)- 1- (4- propoxyphenyl)pyrrolidine- 2,5- dione
Smiles: CCCOc1ccc(cc1)N1C(=O)CC(C1=O)Nc1ccc2c(c1)cccc2

STK547880
Synonyms: 3- (3- fluorophenyl)- 6- hydroxy- 5- (1,2,3,4- tetrahydroisoquinolin- 1- yl)- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: Fc1cccc(c1)n1c(=S)[nH]c(c(c1=O)C1NCCc2c1cccc2)O

STK547882
Synonyms: ethyl1- (3- {[(4- bromophenyl)sulfonyl]amino}- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl)piperidine- 3- carboxylate
Smiles: CCOC(=O)C1CCCN(C1)C1=C(NS(=O)(=O)c2ccc(cc2)Br)C(=O)c2c(C1=O)cccc2

STK547884
Synonyms: 4- acetyl- 3- hydroxy- 5- (4- methoxyphenyl)- 1- [3- (morpholin- 4- yl)propyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)C1N(CCCN2CCOCC2)C(=O)C(=C1C(=O)C)O

STK547886
Synonyms: N- [1- (1H- benzimidazol- 2- yl)ethyl]- 3,5- dinitrobenzamide
Smiles: CC(c1nc2c([nH]1)cccc2)NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]

STK547887
Synonyms: 2,7,8- trimethyl- 3- [(1,3,3- trimethyl- 6- azabicyclo[3.2.1]oct- 6- yl)methyl]quinolin- 4- ol
Smiles: Cc1nc2c(C)c(C)ccc2c(c1CN1CC2(CC1CC(C2)(C)C)C)O

STK547889
Synonyms: 4- (1- methyl- 1H- indol- 3- yl)- 3- nitro- 4- phenylbutan- 2- one
Smiles: Cn1cc(c2c1cccc2)C(C(C(=O)C)[N+](=O)[O-])c1ccccc1

STK547890
Synonyms: 4- [(4- chlorophenyl)carbonyl]- 3- hydroxy- 1- (4- methoxyphenyl)- 5- (3- nitrophenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)N1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)c1ccc(cc1)Cl

STK547891
Synonyms: (8S,8aR,11aS)- 8- [(4- methoxyphenyl)carbonyl]- 10- (naphthalen- 1- yl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc2c1cccc2)cccc3

STK547892
Synonyms: 5- (2- chlorophenyl)- 1,3- diphenyl- 4,5- dihydro- 1H- pyrazole
Smiles: Clc1ccccc1C1CC(=NN1c1ccccc1)c1ccccc1

STK547893
Synonyms: 2- (benzylsulfanyl)- 5- [(3- fluorobenzyl)sulfanyl]- 1,3,4- thiadiazole
Smiles: Fc1cccc(c1)CSc1nnc(s1)SCc1ccccc1

STK547894
Synonyms: (2E)- 2- [4- (propan- 2- yloxy)benzylidene]hydrazinecarbothioamide
Smiles: CC(Oc1ccc(cc1)/C=N/NC(=S)N)C

STK547895
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- phenyl- N'- [(E)- (4- propoxyphenyl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCCOc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK547896
Synonyms: 1- {(Z)- [(2- phenylethyl)imino]methyl}naphthalen- 2- ylbenzenesulfonate
Smiles: O=S(=O)(c1ccccc1)Oc1ccc2c(c1/C=N\CCc1ccccc1)cccc2

STK547897
Synonyms: 3- amino- N- (4- chlorophenyl)- 4- (4- methoxyphenyl)- 6- (thiophen- 2- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1ccc(cc1)c1cc(nc2c1c(N)c(s2)C(=O)Nc1ccc(cc1)Cl)c1cccs1

STK547898
Synonyms: 8- chloro- 4- (1,3,3- trimethyl- 6- azabicyclo[3.2.1]oct- 6- yl)- 5H- pyrimido[5,4- b]indole
Smiles: Clc1ccc2c(c1)c1ncnc(c1[nH]2)N1CC2(CC1CC(C2)(C)C)C

STK547899
Synonyms: 2- {[3- cyano- 4,6- di(thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (1- phenylethyl)acetamide
Smiles: N#Cc1c(SCC(=O)NC(c2ccccc2)C)nc(cc1c1cccs1)c1cccs1

STK547900
Synonyms: 2- {[3- (3- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: COc1cccc(c1)n1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547901
Synonyms: (3aR,4S,9aR,9bS)- 4- [(4- chlorophenyl)carbonyl]- 2- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)OCCO2)C(=O)c1ccccc1

STK547902
Synonyms: 2- amino- 1- (2- chlorobenzyl)- N- (2- methoxyethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1Cl

STK547903
Synonyms: 2- [(2- ethyl- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]- 1- phenylethanone
Smiles: CCc1nc(SCC(=O)c2ccccc2)c2c(n1)sc1c2CC(OC1)(C)C

STK547904
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(2- fluorobenzyl)oxy]phenyl}methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Fc1ccccc1COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK547905
Synonyms: 2- amino- N- (2- methoxyphenyl)- 1- (4- methylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccccc1NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)C

STK547906
Synonyms: 2- (4- methoxyphenyl)- 3- [3- (naphthalen- 2- yloxy)propyl]quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc2c(c1)cccc2

STK547907
Synonyms: 2- amino- N- hexyl- 1- (3,4,5- trimethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(OC)c(c(c1)OC)OC

STK547908
Synonyms: 2- (diethylamino)- 3- [(Z)- {3- [2- (3,4- dimethoxyphenyl)ethyl]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene}methyl]- 9- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCN(c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCc1ccc(c(c1)OC)OC)CC

STK547909
Synonyms: N,N- diethyl- 2- {[3- (3- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)OC)CCCCC3)CC

STK547910
Synonyms: 5- (4- chlorophenyl)- 3- hydroxy- 4- [(4- nitrophenyl)carbonyl]- 1- phenyl- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Clc1ccc(cc1)C1N(c2ccccc2)C(=O)C(=C1C(=O)c1ccc(cc1)[N+](=O)[O-])O

STK547912
Synonyms: 2- [(2- ethyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)sulfanyl]- N- phenylacetamide
Smiles: CCc1nc(SCC(=O)Nc2ccccc2)c2c(n1)sc1c2CCCC1

STK547913
Synonyms: N'- {(E)- [1- (4- ethoxyphenyl)- 4,6- dioxo- 2- thioxotetrahydropyrimidin- 5(2H)- ylidene]methyl}pentanehydrazide
Smiles: CCCCC(=O)NN/C=C/1\C(=O)NC(=S)N(C1=O)c1ccc(cc1)OCC

STK547914
Synonyms: 3- [2- (2- chlorophenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccccc1Cl

STK547915
Synonyms: N- benzyl- 4- (4- tert- butylphenoxy)- 6- methylpyrimidin- 2- amine
Smiles: Cc1cc(Oc2ccc(cc2)C(C)(C)C)nc(n1)NCc1ccccc1

STK547916
Synonyms: 2- {[5- (4- methoxyphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1E)- 1- (naphthalen- 1- yl)ethylidene]acetohydrazide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)N/N=C(/c1cccc2c1cccc2)\C

STK547917
Synonyms: 2- {[6- (1,3- benzodioxol- 5- yl)- 3- cyanopyridin- 2- yl]sulfanyl}- N- [2- chloro- 5- (trifluoromethyl)phenyl]acetamide
Smiles: N#Cc1ccc(nc1SCC(=O)Nc1cc(ccc1Cl)C(F)(F)F)c1ccc2c(c1)OCO2

STK547918
Synonyms: 5- (4- bromophenyl)- 4- [(4- chlorophenyl)carbonyl]- 3- hydroxy- 1- (pyridin- 2- yl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)Br)c1ccccn1

STK547919
Synonyms: 4- acetyl- 1- hexadecyl- 3- hydroxy- 5- (4- hydroxy- 3- methoxyphenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CCCCCCCCCCCCCCCCN1C(=O)C(=C(C1c1ccc(c(c1)OC)O)C(=O)C)O

STK547920
Synonyms: (8S,8aR,11aS)- 10- (4- fluorophenyl)- 8- [(3- nitrophenyl)carbonyl]- 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)C1N([C@@H]2C(=O)c2cccc(c2)[N+](=O)[O-])C=Cc2c1cccc2

STK547922
Synonyms: ethyl6- bromo- 4- [(2,5- dimethoxyphenyl)amino]quinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1cc(OC)ccc1OC)cc(cc2)Br

STK547923
Synonyms: N,N- diethyl- 2- {[8- (2- methylprop- 2- en- 1- yl)- 7- oxo- 5,6,7,8- tetrahydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 9- yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nc2sc3c(c2c(=O)n1CC(=C)C)CCc1c3cccc1)CC

STK547924
Synonyms: 3- [5- (4- nitrophenyl)thiophen- 2- yl]- 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(s1)c1ccc(cc1)[N+](=O)[O-]

STK547927
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {5- chloro- 2- [(2,6- dichlorobenzyl)oxy]phenyl}methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Clc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N)OCc1c(Cl)cccc1Cl

STK547928
Synonyms: 2- chloro- N- (12- cyanoindolizino[2,3- b]quinoxalin- 2- yl)benzamide
Smiles: N#Cc1c2cc(ccn2c2c1nc1ccccc1n2)NC(=O)c1ccccc1Cl

STK547930
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (1,3- benzodioxol- 5- yl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc2c(c1)OCO2)C

STK547931
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (4- fluorophenyl)methylidene]- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Fc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N

STK547932
Synonyms: 8- (azepan- 1- ylmethyl)- 3- (2- bromophenoxy)- 7- hydroxy- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: Oc1ccc2c(c1CN1CCCCCC1)oc(c(c2=O)Oc1ccccc1Br)C(F)(F)F

STK547933
Synonyms: methyl[(2- ethyl- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]acetate
Smiles: COC(=O)CSc1nc(CC)nc2c1c1CC(C)(C)OCc1s2

STK547935
Synonyms: N- (2,4- dimethylphenyl)- 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3

STK547936
Synonyms: 3- (3,5- dimethylphenyl)- 11- (3- methylphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Cc1cccc(c1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)c1cc(C)cc(c1)C

STK547938
Synonyms: 2- (4- methoxyphenyl)- 3- [3- (4- methylphenoxy)propyl]quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc(cc1)C

STK547940
Synonyms: 5- (4- ethoxyphenyl)- 2,3,3a- triphenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: CCOc1ccc(cc1)N1C(=O)C2C(C1=O)(c1ccccc1)C(N(O2)c1ccccc1)c1ccccc1

STK547941
Synonyms: (2Z)- [4- (4- fluorophenyl)- 1,3- thiazol- 2- yl](hydroxyimino)ethanenitrile
Smiles: O/N=C(\c1scc(n1)c1ccc(cc1)F)/C#N

STK547944
Synonyms: ethyl6- amino- 5- cyano- 4- (2- fluorophenyl)- 2- (4- methoxyphenyl)- 4H- pyran- 3- carboxylate
Smiles: CCOC(=O)C1=C(OC(=C(C1c1ccccc1F)C#N)N)c1ccc(cc1)OC

STK547945
Synonyms: 2- amino- N- butyl- 1- (3- chloro- 4- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)OC

STK547946
Synonyms: 3- (2- chlorophenyl)- 8- [(diethylamino)methyl]- 7- hydroxy- 4H- chromen- 4- one
Smiles: CCN(Cc1c(O)ccc2c1occ(c2=O)c1ccccc1Cl)CC

STK547948
Synonyms: 3- {[benzyl(methyl)amino]methyl}- 2,7,8- trimethylquinolin- 4- ol
Smiles: CN(Cc1c(C)nc2c(c1O)ccc(c2C)C)Cc1ccccc1

STK547950
Synonyms: 4- fluoro- N- {1- (3- methoxypropyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}benzenesulfonamide
Smiles: COCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)F)S(=O)(=O)c1ccc(cc1)C

STK547951
Synonyms: 2- [(6,6- dimethyl- 2- phenyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]- 1- phenylethanone
Smiles: O=C(c1ccccc1)CSc1nc(nc2c1c1CC(C)(C)OCc1s2)c1ccccc1

STK547954
Synonyms: 3- hydroxy- 1- (4- methoxyphenyl)- 5- phenyl- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1)C(=O)c1ccccc1)O

STK547955
Synonyms: 2- amino- 1- (1,3- benzodioxol- 5- yl)- N- [2- (4- methoxyphenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccc(cc1)CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc2c(c1)OCO2

STK547956
Synonyms: 1- (4- fluorophenyl)- 3- hydroxy- 4- [(4- methylphenyl)carbonyl]- 5- (4- nitrophenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)F

STK547957
Synonyms: 2- ({5- [(4- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)- N'- [(E)- (3,4- dichlorophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccc(cc1)Cl)N/N=C/c1ccc(c(c1)Cl)Cl

STK547958
Synonyms: 1- (4- bromophenyl)- 3- hydroxy- 5- (4- methoxyphenyl)- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)C1N(c2ccc(cc2)Br)C(=O)C(=C1C(=O)c1ccccc1)O

STK547959
Synonyms: ethyl(8S,8aR)- 6- amino- 5,7,7- tricyano- 8- {3- ethoxy- 4- [2- (morpholin- 4- yl)ethoxy]phenyl}- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCOc1cc(ccc1OCCN1CCOCC1)[C@@H]1[C@H]2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(=O)OCC

STK547960
Synonyms: 3- methyl- 1- (4- methylphenyl)- 4- {(E)- [(6- methylpyridin- 2- yl)imino]methyl}- 1H- pyrazol- 5- ol
Smiles: Cc1ccc(cc1)n1nc(c(c1O)/C=N/c1cccc(n1)C)C

STK547961
Synonyms: 2- (2- cyanoethyl)- 1- [(4- ethoxyphenyl)amino]- 3- methylpyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: N#CCCc1c(C)c(C#N)c2n(c1Nc1ccc(cc1)OCC)c1ccccc1n2

STK547962
Synonyms: 2- {[6- amino- 3,5- dicyano- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (4- methoxy- 2- methylphenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2C)OC)nc(c(c1c1cccs1)C#N)N

STK547963
Synonyms: 9- (4- fluorophenyl)- 2- (2,4,6- trimethylphenyl)tetrahydro- 5H- pyrazolo[1,2- a]pyrrolo[3,4- c]pyrazole- 1,3(2H,3aH)- dione
Smiles: Cc1cc(C)c(c(c1)C)N1C(=O)C2C(C1=O)N1N(C2c2ccc(cc2)F)CCC1

STK547964
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (2,4- dimethylphenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1C)C)cccc3

STK547965
Synonyms: 2- (methylsulfanyl)- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCn1c(SC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547966
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(3- bromo- 4- methoxyphenyl)carbonyl]- 2'- [(3- nitrophenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccc(c1)[N+](=O)[O-])C(=O)Nc1c2cccc1)cccc3

STK547967
Synonyms: (6aS,6bR,9aS,10R)- 10- [(3- bromo- 4- methoxyphenyl)carbonyl]- 8- (2- chlorophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccccc1Cl)C=Cc1c2cccc1

STK547968
Synonyms: N~2~- benzyl- N~4~,6- dimethylpyrimidine- 2,4- diamine
Smiles: CNc1nc(NCc2ccccc2)nc(c1)C

STK547969
Synonyms: N'- [(3Z)- 2- oxo- 1- (prop- 2- yn- 1- yl)- 1,2- dihydro- 3H- indol- 3- ylidene]pyridine- 2- carbohydrazide
Smiles: C#CCN1c2ccccc2/C(=N/NC(=O)c2ccccn2)/C1=O

STK547970
Synonyms: (8S,8aR,11aS)- 10- (3,5- dichlorophenyl)- 8- [(3- nitrophenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Clc1cc(Cl)cc(c1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2cccc(c2)[N+](=O)[O-])C=Cc2c1cccc2

STK547971
Synonyms: 1- [3- (4- bromophenyl)- 5- (4- fluorophenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 2- chloroethanone
Smiles: ClCC(=O)N1N=C(CC1c1ccc(cc1)F)c1ccc(cc1)Br

STK547972
Synonyms: ethyl4- (4- oxo- 2- pentylquinazolin- 3(4H)- yl)benzoate
Smiles: CCCCCc1nc2ccccc2c(=O)n1c1ccc(cc1)C(=O)OCC

STK547973
Synonyms: methyl5- chloro- 3- {[3- (3,5- dimethylpiperidin- 1- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CC(C)CC(C1)C)cc(cc2)Cl

STK547974
Synonyms: N- [1- (1- benzyl- 1H- benzimidazol- 2- yl)- 3- (methylsulfanyl)propyl]- 4- fluorobenzamide
Smiles: CSCCC(c1nc2c(n1Cc1ccccc1)cccc2)NC(=O)c1ccc(cc1)F

STK547975
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (4- bromophenyl)methylidene]- 5- (morpholin- 4- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCOCC1)c1nonc1N)N/N=C/c1ccc(cc1)Br

STK547976
Synonyms: 2- imino- N- (2- methoxyethyl)- 10- methyl- 5- oxo- 1- propyl- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: CCCn1c(=N)c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCCOC

STK547977
Synonyms: 7,8- dimethoxy- 2- (2- phenoxyethyl)phthalazin- 1(2H)- one
Smiles: COc1c(OC)ccc2c1c(=O)n(nc2)CCOc1ccccc1

STK547979
Synonyms: 11- (3- bromophenyl)- 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)Br)c(nn1c1ccccc1)C

STK547980
Synonyms: methyl5- ({4- [(E)- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- phenyl- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)methyl]- 2- ethoxyphenoxy}methyl)furan- 2- carboxylate
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)ccc1OCc1ccc(o1)C(=O)OC

STK547981
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- phenyl- N'- [(E)- pyridin- 3- ylmethylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1c1ccccc1)c1nonc1N)N/N=C/c1cccnc1

STK547982
Synonyms: 3- butyl- 2- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCn1c(SCC(=C)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK547983
Synonyms: 4- [(4- chlorophenyl)carbonyl]- 5- (4- fluorophenyl)- 3- hydroxy- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Fc1ccc(cc1)C1NC(=O)C(=C1C(=O)c1ccc(cc1)Cl)O

STK547984
Synonyms: 2- methylbenzylN'- cyano- N- (4- ethoxyphenyl)carbamimidothioate
Smiles: CCOc1ccc(cc1)N/C(=N\C#N)/SCc1ccccc1C

STK547985
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 4- [(2- chlorobenzyl)oxy]- 5- methoxyphenyl}methylidene]- 5- methyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)cc(c1OCc1ccccc1Cl)Br

STK547986
Synonyms: 4- [(4- methyl- 3,6- dihydro- 2H- pyran- 3- yl)oxy]- N- {(E)- [4- (nonyloxy)phenyl]methylidene}aniline
Smiles: CCCCCCCCCOc1ccc(cc1)/C=N/c1ccc(cc1)OC1COCC=C1C

STK547987
Synonyms: N- (4- chlorophenyl)- 2- (pyridin- 3- yl)quinazolin- 4- amine
Smiles: Clc1ccc(cc1)Nc1nc(nc2c1cccc2)c1cccnc1

STK547988
Synonyms: ethyl4- [{2- [(4- chlorophenoxy)acetyl]hydrazinyl}(oxo)acetyl]piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)C(=O)NNC(=O)COc1ccc(cc1)Cl

STK547989
Synonyms: 3- (4- bromophenyl)- 5- (4- chloro- 3- fluorophenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: Brc1ccc(cc1)C1C2C(=O)N(C(=O)C2ON1c1ccccc1)c1ccc(c(c1)F)Cl

STK547990
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (3,4- dimethoxyphenyl)methylidene]- 5- methyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)ccc1OC

STK547993
Synonyms: N'~1~- [(3E)- 1- butyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]- N'~5~- [(3Z)- 1- butyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]pentanedihydrazide
Smiles: CCCCN1C(=O)/C(=N/NC(=O)CCCC(=O)N/N=C\2/c3ccccc3N(C2=O)CCCC)/c2c1cccc2

STK547994
Synonyms: 2- (4- methoxyphenyl)- 3- [3- (3- methylphenoxy)propyl]quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cccc(c1)C

STK547995
Synonyms: 2- {[3- cyano- 6- phenyl- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (propan- 2- yl)acetamide
Smiles: N#Cc1c(SCC(=O)NC(C)C)nc(cc1c1cccs1)c1ccccc1

STK547997
Synonyms: 4- chloro- N- [5- (2- methoxyethyl)- 1,3,4- thiadiazol- 2- yl]benzamide
Smiles: COCCc1nnc(s1)NC(=O)c1ccc(cc1)Cl

STK547998
Synonyms: 3- amino- N- (4- chlorobenzyl)- 6- ethyl- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: CCC1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)NCc1ccc(cc1)Cl

STK548000
Synonyms: (8S,8aR,11aS)- 10- (2- methoxy- 5- nitrophenyl)- 8- [(3- nitrophenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1C2c2ccccc2C=C1)C(=O)c1cccc(c1)[N+](=O)[O-])[N+](=O)[O-]

STK548001
Synonyms: 2- (4- bromophenyl)- 2- oxoethyl4- (4- nitrophenyl)- 3a,4,5,9b- tetrahydro- 3H- cyclopenta[c]quinoline- 8- carboxylate
Smiles: Brc1ccc(cc1)C(=O)COC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccc(cc1)[N+](=O)[O-]

STK548002
Synonyms: 3- amino- 4- (4- chlorophenyl)- N- (propan- 2- yl)- 6- (thiophen- 2- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: CC(NC(=O)c1sc2c(c1N)c(cc(n2)c1cccs1)c1ccc(cc1)Cl)C

STK548003
Synonyms: 3- methyl- 1- [4- (naphthalen- 1- ylmethyl)piperazin- 1- yl]- 2- octylpyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1N1CCN(CC1)Cc1cccc3c1cccc3)c1ccccc1n2

STK548006
Synonyms: (phenylsulfonyl)(3- {4- [(thiophen- 2- ylcarbonyl)amino]pyridinium- 1- yl}quinoxalin- 2- yl)azanide
Smiles: O=C(c1cccs1)Nc1cc[n+](cc1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccccc1

STK548009
Synonyms: 6- bromo- 2- methyl- 3- (piperidin- 1- ylmethyl)quinolin- 4(1H)- one
Smiles: Cc1[nH]c2ccc(cc2c(=O)c1CN1CCCCC1)Br

STK548010
Synonyms: (6aS,6bR,9aS,10R)- 8- (1,3- benzodioxol- 5- yl)- 10- [(3- bromo- 4- methoxyphenyl)carbonyl]- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc3c(c1)OCO3)C=Cc1c2cccc1

STK548011
Synonyms: 5- (3- fluorophenyl)- 3- hydroxy- 4- (phenylcarbonyl)- 1- (2- phenylethyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Fc1cccc(c1)C1C(=C(C(=O)N1CCc1ccccc1)O)C(=O)c1ccccc1

STK548012
Synonyms: 3- methyl- 2- octyl- 1- (phenylamino)pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1Nc1ccccc1)c1ccccc1n2

STK548013
Synonyms: N- (3- cyano- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl)- 2- {[3- cyano- 6- phenyl- 4- (trifluoromethyl)pyridin- 2- yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)Nc2sc3c(c2C#N)CCC3)nc(cc1C(F)(F)F)c1ccccc1

STK548014
Synonyms: 1- [(4- tert- butylbenzyl)oxy]- 3- (4- methylphenyl)quinoxalin- 2(1H)- one4- oxide
Smiles: Cc1ccc(cc1)c1c(=O)n(OCc2ccc(cc2)C(C)(C)C)c2c([n+]1[O-])cccc2

STK548016
Synonyms: 4- fluorobenzylN'- cyano- N- (2- fluorophenyl)carbamimidothioate
Smiles: N#C/N=C(/Nc1ccccc1F)\SCc1ccc(cc1)F

STK548017
Synonyms: N,N'- bis[(E)- 1,3- benzodioxol- 5- ylmethylidene]propane- 1,2- diamine
Smiles: CC(/N=C/c1ccc2c(c1)OCO2)C/N=C/c1ccc2c(c1)OCO2

STK548018
Synonyms: prop- 2- en- 1- yl2- amino- 1- (2- methoxybenzyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1OC

STK548019
Synonyms: prop- 2- en- 1- yl2- amino- 1- (3- chlorophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)Cl

STK548020
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (3- nitrophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-])cccc3

STK548021
Synonyms: 4- ethyl- 2,6- bis(furan- 2- ylmethyl)- 9,10- diphenylhexahydro- 4,8- ethenopyrrolo[3,4- f]isoindole- 1,3,5,7(2H,6H)- tetrone
Smiles: CCC12C3C(=O)N(C(=O)C3C(C3C1C(=O)N(C3=O)Cc1ccco1)C(=C2c1ccccc1)c1ccccc1)Cc1ccco1

STK548022
Synonyms: 6- bromo- 4- (2- chlorophenyl)- 3- (piperidin- 1- yl)- 3,4- dihydroquinolin- 2(1H)- one
Smiles: Brc1ccc2c(c1)C(C(C(=O)N2)N1CCCCC1)c1ccccc1Cl

STK548023
Synonyms: 2- {[4,5- bis(4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- 1H- indol- 3- ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C)N/N=C/c1c[nH]c2c1cccc2

STK548024
Synonyms: 2- (2- fluorophenyl)- N- (furan- 2- ylmethyl)quinazolin- 4- amine
Smiles: Fc1ccccc1c1nc(NCc2ccco2)c2c(n1)cccc2

STK548025
Synonyms: ethyl1- {2- [(3- tert- butyl- 8,13- dioxo- 13,14- dihydro- 8H- naphtho[2,3- a]phenoxazin- 7- yl)amino]ethyl}piperidine- 3- carboxylate
Smiles: CCOC(=O)C1CCCN(C1)CCNc1cc2oc3cc(ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1)C(C)(C)C

STK548026
Synonyms: methyl2- {[(2E)- 3- (4- chlorophenyl)- 2- cyanoprop- 2- enoyl]amino}- 4,5- dimethylthiophene- 3- carboxylate
Smiles: N#C/C(=C\c1ccc(cc1)Cl)/C(=O)Nc1sc(c(c1C(=O)OC)C)C

STK548027
Synonyms: 5- cyano- 6- {[2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)- 2- oxoethyl]sulfanyl}- 2- methyl- N- phenyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)N2CCc3c(C2)cc(c(c3)OC)OC)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1)C

STK548029
Synonyms: 2- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 7- tert- butyl- 3- (3- methylphenyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: Cc1cccc(c1)n1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)c1CCC(Cc1s2)C(C)(C)C

STK548030
Synonyms: 3- hydroxy- 4- [(4- methylphenyl)carbonyl]- 5- phenyl- 1- (2- phenylethyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1)CCc1ccccc1

STK548031
Synonyms: 3- (4- bromophenyl)- 6- iodo- 2- [(E)- 2- (2- nitrophenyl)ethenyl]quinazolin- 4(3H)- one
Smiles: Brc1ccc(cc1)n1c(/C=C/c2ccccc2[N+](=O)[O-])nc2c(c1=O)cc(cc2)I

STK548032
Synonyms: (1'R,2'R)- 2'- (4- methoxyphenyl)- 1'- (phenylcarbonyl)- 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](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1

STK548033
Synonyms: 11- benzyl- 3- (4- ethoxyphenyl)- 2- methyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCOc1ccc(cc1)n1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccccc1

STK548034
Synonyms: N'- [(1E)- 1- (4- chlorophenyl)ethylidene]- 4- [(5- methyl- 3- nitro- 1H- pyrazol- 1- yl)methyl]benzohydrazide
Smiles: Clc1ccc(cc1)/C(=N/NC(=O)c1ccc(cc1)Cn1nc(cc1C)[N+](=O)[O-])/C

STK548035
Synonyms: 1- ethoxy- 3- (4- methoxyphenyl)quinoxalin- 2(1H)- one4- oxide
Smiles: CCOn1c(=O)c(c2ccc(cc2)OC)[n+](c2c1cccc2)[O-]

STK548036
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 4- [(4- chlorobenzyl)oxy]- 5- methoxyphenyl}methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)cc(c1OCc1ccc(cc1)Cl)Br

STK548037
Synonyms: methyl(1R,2R,3S,3aS)- 1- [(3- bromo- 4- methoxyphenyl)carbonyl]- 2- (4- bromophenyl)- 3- cyano- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinoline- 3- carboxylate
Smiles: COC(=O)[C@@]1(C#N)[C@@H](c2ccc(cc2)Br)[C@@H](N2[C@H]1C=Cc1c2cccc1)C(=O)c1ccc(c(c1)Br)OC

STK548038
Synonyms: 11- (3,4- dimethylphenyl)- 3- (2- methoxyphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccccc1n1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)C)C

STK548039
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (4- methylphenyl)methylidene]- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Cc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N

STK548040
Synonyms: ethyl4- [(4- acetylphenyl)amino]- 6,8- dichloroquinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(cc1)C(=O)C)cc(cc2Cl)Cl

STK548041
Synonyms: 11- [4- (benzyloxy)phenyl]- 3- (4- methylphenyl)- 10- (trifluoroacetyl)- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: Cc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1ccc(cc1)OCc1ccccc1)C(=O)C(F)(F)F

STK548042
Synonyms: methyl(1R,2R,3S,3aS)- 1- [(3- bromo- 4- methoxyphenyl)carbonyl]- 3- cyano- 2- [4- (dimethylamino)phenyl]- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinoline- 3- carboxylate
Smiles: COC(=O)[C@@]1(C#N)[C@@H](c2ccc(cc2)N(C)C)[C@@H](N2[C@H]1C=Cc1c2cccc1)C(=O)c1ccc(c(c1)Br)OC

STK548043
Synonyms: N- [3- cyano- 1- (2- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl]benzenesulfonamide
Smiles: N#Cc1c(NS(=O)(=O)c2ccccc2)n(c2c1nc1ccccc1n2)c1ccccc1OC

STK548044
Synonyms: N- (diphenylmethyl)- 2- [(5- phenyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1

STK548045
Synonyms: N- (4- bromophenyl)- 4- [4- (prop- 2- yn- 1- yloxy)phenyl]phthalazin- 1- amine
Smiles: C#CCOc1ccc(cc1)c1nnc(c2c1cccc2)Nc1ccc(cc1)Br

STK548047
Synonyms: 5- (4- bromophenyl)- 4- [(4- chlorophenyl)carbonyl]- 3- hydroxy- 1- phenyl- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)Br)c1ccccc1

STK548048
Synonyms: N- {2- [(5,6- dimethyl- 1,3- benzothiazol- 2- yl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}- 3- phenylpropanamide
Smiles: O=C(NC(C(F)(F)F)(C(F)(F)F)Nc1sc2c(n1)cc(c(c2)C)C)CCc1ccccc1

STK548050
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [4- (benzyloxy)- 3- methoxyphenyl]methylidene}- 5- methyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)ccc1OCc1ccccc1

STK548051
Synonyms: [(4- bromophenyl)sulfonyl][3- (1- methyl- 1H- imidazol- 3- ium- 3- yl)- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl]azanide
Smiles: Brc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2ccn(c2)C)C(=O)c2c(C1=O)cccc2

STK548052
Synonyms: N- [(3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)carbamothioyl]- 3,4,5- trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)NC(=S)Nc1sc2c(c1C#N)CCCC2

STK548054
Synonyms: 2,6- dimethoxy- N- {[4- (1,3- thiazol- 2- ylsulfamoyl)phenyl]carbamothioyl}benzamide
Smiles: COc1cccc(c1C(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1)OC

STK548056
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (naphthalen- 1- yl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc2c1cccc2)cccc3

STK548057
Synonyms: propan- 2- ylcyano(3- {4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}quinoxalin- 2- yl)acetate
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)C/C=C/c1ccccc1)C(=O)OC(C)C

STK548058
Synonyms: N- (2,4- dimethoxyphenyl)- 10- methyl- 8- phenyl- 11- (3,4,5- trimethoxyphenyl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(c(c1)OC)Nc1nc2ccccc2n2c1=Nc1c(C2c2cc(OC)c(c(c2)OC)OC)c(nn1c1ccccc1)C

STK548060
Synonyms: 6- amino- 4- (2- chloroquinolin- 3- yl)- 3- propyl- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: CCCc1[nH]nc2c1C(C(=C(O2)N)C#N)c1cc2ccccc2nc1Cl

STK548061
Synonyms: (8S,8aR,11aS)- 10- (4- fluorophenyl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)F)cccc3

STK548063
Synonyms: 6- {[4- (tert- butylamino)- 6- (ethylamino)- 1,3,5- triazin- 2- yl]oxy}- 2- methylpyridazin- 3(2H)- one
Smiles: CCNc1nc(Oc2ccc(=O)n(n2)C)nc(n1)NC(C)(C)C

STK548064
Synonyms: 5- (2- acetyl- 1,2,3,4- tetrahydroisoquinolin- 1- yl)- 6- hydroxy- 3- (2- methylphenyl)- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: CC(=O)N1CCc2c(C1c1c(O)[nH]c(=S)n(c1=O)c1ccccc1C)cccc2

STK548065
Synonyms: ethyl[6- amino- 5- cyano- 4- (cyclohex- 2- en- 1- yl)- 2,4- dihydropyrano[2,3- c]pyrazol- 3- yl]acetate
Smiles: CCOC(=O)Cc1[nH]nc2c1C(C1CCCC=C1)C(=C(O2)N)C#N

STK548066
Synonyms: 2- [(6,6- dimethyl- 2- phenyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]- N- (4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nc(nc2c1c1CC(C)(C)OCc1s2)c1ccccc1

STK548067
Synonyms: N- (2,4- 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(cc1C)C)c1ccccc1

STK548068
Synonyms: 1- (4- fluorophenyl)- 3- hydroxy- 5- (4- methylphenyl)- 4- [(4- methylphenyl)carbonyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Cc1ccc(cc1)C1C(=C(C(=O)N1c1ccc(cc1)F)O)C(=O)c1ccc(cc1)C

STK548069
Synonyms: 3- (1- methyl- 1H- indol- 3- yl)- 1- (naphthalen- 2- yl)pyrrolidine- 2,5- dione
Smiles: O=C1CC(C(=O)N1c1ccc2c(c1)cccc2)c1cn(c2c1cccc2)C

STK548070
Synonyms: 1- (5,6- dimethyl- 1H- benzimidazol- 1- yl)- 3- (naphthalen- 1- yloxy)propan- 2- ol
Smiles: OC(Cn1cnc2c1cc(C)c(c2)C)COc1cccc2c1cccc2

STK548071
Synonyms: (5E)- 2- [4- (3- chlorophenyl)piperazin- 1- yl]- 5- {2- [(4- nitrobenzyl)oxy]benzylidene}- 1,3- thiazol- 4(5H)- one
Smiles: Clc1cccc(c1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccccc2OCc2ccc(cc2)[N+](=O)[O-])/S1

STK548072
Synonyms: 2- (piperidin- 1- yl)- N- (tricyclo[3.3.1.1~3,7~]dec- 1- ylmethyl)acetamide
Smiles: O=C(CN1CCCCC1)NCC12CC3CC(C2)CC(C1)C3

STK548073
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (naphthalen- 1- yl)- 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)c1cccc2c1cccc2)cccc3

STK548074
Synonyms: (2E)- 2- {[8- (benzyloxy)quinolin- 2- yl]methylidene}hydrazinecarboxamide
Smiles: NC(=O)N/N=C/c1ccc2c(n1)c(ccc2)OCc1ccccc1

STK548075
Synonyms: 4- bromo- N- [(3- cyano- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophen- 2- yl)carbamothioyl]benzamide
Smiles: N#Cc1c(NC(=S)NC(=O)c2ccc(cc2)Br)sc2c1CCCCC2

STK548076
Synonyms: 4- {(2Z)- 2- [3- chloro- 5- (4- fluorophenyl)- 2- (4- methylphenyl)- 1- benzoxepin- 4(5H)- ylidene]ethyl}morpholine
Smiles: Cc1ccc(cc1)C1=C(Cl)/C(=C\CN2CCOCC2)/C(c2c(O1)cccc2)c1ccc(cc1)F

STK548077
Synonyms: 2- {[6- (1,3- benzodioxol- 5- yl)- 3- cyanopyridin- 2- yl]sulfanyl}- N- [5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]acetamide
Smiles: N#Cc1ccc(nc1SCC(=O)Nc1nnc(s1)SCc1ccccc1)c1ccc2c(c1)OCO2

STK548078
Synonyms: (3S)- 2- {2- [(2- chlorobenzyl)oxy]phenyl}- 3- (tricyclo[3.3.1.1~3,7~]dec- 1- ylcarbonyl)cyclopropane- 1,1- dicarbonitrile
Smiles: N#CC1(C#N)[C@H](C1c1ccccc1OCc1ccccc1Cl)C(=O)C12CC3CC(C2)CC(C1)C3

STK548079
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [3- (1H- benzotriazol- 1- ylmethyl)- 4- methoxyphenyl]methylidene}- 5- [(4- methylpiperazin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1ccc(cc1Cn1nnc2c1cccc2)/C=N/NC(=O)c1nnn(c1CN1CCN(CC1)C)c1nonc1N

STK548080
Synonyms: 3- hydroxy- 4- [(4- methylphenyl)carbonyl]- 5- (3- nitrophenyl)- 1- (2- phenylethyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])CCc1ccccc1

STK548081
Synonyms: N- [(E)- {4- [(4- methyl- 3,6- dihydro- 2H- pyran- 3- yl)oxy]phenyl}methylidene]- 4- (nonyloxy)aniline
Smiles: CCCCCCCCCOc1ccc(cc1)/N=C/c1ccc(cc1)OC1COCC=C1C

STK548082
Synonyms: 3- [5- (2- bromo- 4- chlorophenoxy)pentyl]- 2- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1ccc(cc1Br)Cl

STK548083
Synonyms: 2- imino- 1- methyl- 5- oxo- N- (2- phenylethyl)- 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)cccc1)NCCc1ccccc1

STK548085
Synonyms: 5- (4- chlorophenyl)- 3- hydroxy- 1- (4- methylphenyl)- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Clc1ccc(cc1)C1N(c2ccc(cc2)C)C(=O)C(=C1C(=O)c1ccccc1)O

STK548086
Synonyms: 2- methyl- 7- {[2- (2- methylpiperidin- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: Cc1ccc2c(c1)[nH]c1c(o2)cc(c2c1c(=O)c1c(c2=O)cccc1)NCCN1CCCCC1C

STK548087
Synonyms: 2- [(1,3- benzodioxol- 5- ylmethyl)sulfanyl]- 3- methyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: Cn1c(SCc2ccc3c(c2)OCO3)nc2c(c1=O)c1CCCCc1s2

STK548088
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(2- chloro- 6- fluorobenzyl)oxy]- 3- methoxyphenyl}methylidene]- 5- (phenoxymethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2COc2ccccc2)c2nonc2N)ccc1OCc1c(F)cccc1Cl

STK548089
Synonyms: 4- amino- N'- [(E)- (2- methoxynaphthalen- 1- yl)methylidene]- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: COc1ccc2c(c1/C=N/N=C(/c1nonc1N)\N)cccc2

STK548090
Synonyms: 5- (4- chlorobenzyl)- 4- (2- methylphenyl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: Clc1ccc(cc1)Cc1nnc(n1c1ccccc1C)S

STK548091
Synonyms: (8S,8aR,11aS)- 10- (4- acetylphenyl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)C(=O)C)cccc3

STK548092
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 4- [(3- chlorobenzyl)oxy]- 5- ethoxyphenyl}methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)cc(c1OCc1cccc(c1)Cl)Br

STK548093
Synonyms: N- [3- (3,6- dichloro- 9H- carbazol- 9- yl)- 2- hydroxypropyl]- N- (4- fluorophenyl)- 4- methylbenzenesulfonamide
Smiles: Fc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)C)CC(Cn1c2ccc(cc2c2c1ccc(c2)Cl)Cl)O

STK548094
Synonyms: (1'R,2'R)- 2'- phenyl- 1'- (phenylcarbonyl)- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: O=C([C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccccc1)C(=O)c1c(C2=O)cccc1)c1ccccc1

STK548095
Synonyms: (9E)- 3- (4- chlorophenyl)- 9- (4- methoxybenzylidene)- 5- (4- methoxyphenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: COc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Cl)/C(=C/c1ccc(cc1)OC)/CCC2

STK548096
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- [(2- chlorobenzyl)oxy]phenyl}methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Clc1ccccc1COc1cccc(c1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK548097
Synonyms: (5E)- 2- [4- (naphthalen- 1- yl)piperazin- 1- yl]- 5- {4- [(4- nitrobenzyl)oxy]benzylidene}- 1,3- thiazol- 4(5H)- one
Smiles: O=C1N=C(S/C/1=C/c1ccc(cc1)OCc1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)c1cccc2c1cccc2

STK548098
Synonyms: 2- amino- N- (2,5- dimethylphenyl)- 1- (3,5- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Cc1ccc(c(c1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(C)cc(c1)C)C

STK548099
Synonyms: 3- [3- (2- bromo- 4- methylphenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc(cc1Br)C

STK548100
Synonyms: 4- [5- (2- methoxyphenoxy)- 1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl]benzamide
Smiles: COc1ccccc1Oc1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)C(=O)N

STK548103
Synonyms: ethyl3- {4- cyano- 1- [(4- fluorophenyl)amino]- 3- methylpyrido[1,2- a]benzimidazol- 2- yl}propanoate
Smiles: CCOC(=O)CCc1c(C)c(C#N)c2n(c1Nc1ccc(cc1)F)c1ccccc1n2

STK548104
Synonyms: 4- [3- acetyl- 4- hydroxy- 2- (3- nitrophenyl)- 5- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl]benzoicacid
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1ccc(cc1)C(=O)O

STK548105
Synonyms: 2- {[3- (2- methylprop- 2- en- 1- yl)- 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(=C)C)CCCCC3)CCC

STK548106
Synonyms: 3- {4- (4- ethoxyphenyl)- 5- [(4- nitrobenzyl)sulfanyl]- 4H- 1,2,4- triazol- 3- yl}pyridine
Smiles: CCOc1ccc(cc1)n1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1cccnc1

STK548107
Synonyms: 2- amino- 1- (3,4- dichlorophenyl)- N- (3,4- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Cc1cc(ccc1C)NC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccc(c(c1)Cl)Cl

STK548108
Synonyms: 2- [4- (2- hydroxyethyl)piperazin- 1- yl]- 7- methyl- 3- {(Z)- [4- oxo- 3- (tetrahydrofuran- 2- ylmethyl)- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: OCCN1CCN(CC1)c1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CC1CCCO1)C

STK548110
Synonyms: N- {(2Z,4E)- 1- [(4- methoxyphenyl)amino]- 1- oxo- 5- phenylpenta- 2,4- dien- 2- yl}benzamide
Smiles: COc1ccc(cc1)NC(=O)/C(=C/C=C/c1ccccc1)/NC(=O)c1ccccc1

STK548112
Synonyms: (6aS,6bR,9aS,10R)- 10- [(3- bromo- 4- methoxyphenyl)carbonyl]- 8- (2,4- dichlorophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1Cl)Cl)C=Cc1c2cccc1

STK548113
Synonyms: 4- chloro- N- {(1E)- 1- (3,4- diethoxyphenyl)- 3- [(2- hydroxyethyl)amino]- 3- oxoprop- 1- en- 2- yl}benzamide
Smiles: OCCNC(=O)/C(=C\c1ccc(c(c1)OCC)OCC)/NC(=O)c1ccc(cc1)Cl

STK548114
Synonyms: N'- [(E)- (2- fluorophenyl)methylidene]- 2- (5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])N/N=C/c1ccccc1F

STK548115
Synonyms: 2- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCn1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548116
Synonyms: 4- {6- [(3- chloro- 4- fluorophenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}benzene- 1,2- diol
Smiles: Cc1nn(c2c1C(c1ccc(c(c1)O)O)n1c(=N2)c(Nc2ccc(c(c2)Cl)F)nc2c1cccc2)c1ccccc1

STK548117
Synonyms: 2- (2,4- dimethoxyphenyl)- 10- iminotetrahydro- 8a,3- (epoxymethano)chromene- 3,4,4(2H,4aH)- tricarbonitrile
Smiles: N#CC12C(=N)OC3(OC1c1ccc(cc1OC)OC)C(C2(C#N)C#N)CCCC3

STK548118
Synonyms: (8S,8aR,11aS)- 10- (4- acetylphenyl)- 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]1[C@@H]2C(=O)N(C(=O)[C@@H]2C2N1N=Cc1c2cccc1)c1ccc(cc1)C(=O)C

STK548119
Synonyms: 3- (4- benzylpiperazin- 1- yl)- 4- chloro- 1- (2,5- dichlorophenyl)- 1H- pyrrole- 2,5- dione
Smiles: Clc1ccc(c(c1)N1C(=O)C(=C(C1=O)Cl)N1CCN(CC1)Cc1ccccc1)Cl

STK548120
Synonyms: 2- [(2- methoxyphenyl)amino]- 2- oxoethylN'- cyano- N- (3- fluorophenyl)carbamimidothioate
Smiles: N#C/N=C(\Nc1cccc(c1)F)/SCC(=O)Nc1ccccc1OC

STK548121
Synonyms: 4- methoxy- N- [(4- methoxyphenyl)carbonyl]- N- (4- methylpyridin- 2- yl)benzamide
Smiles: COc1ccc(cc1)C(=O)N(C(=O)c1ccc(cc1)OC)c1nccc(c1)C

STK548123
Synonyms: 2- (4- methoxyphenyl)- 3- {3- [2- methyl- 5- (propan- 2- yl)phenoxy]propyl}quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cc(ccc1C)C(C)C

STK548124
Synonyms: (2E)- 3- (5- iodofuran- 2- yl)prop- 2- enoicacid
Smiles: OC(=O)/C=C/c1ccc(o1)I

STK548126
Synonyms: N- (3- methoxyphenyl)- 2- [(5- phenyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc2n1c(nc1c2c2CCCc2s1)c1ccccc1

STK548128
Synonyms: (5E)- 4- bromo- 5- {[(2,4- dibromophenyl)carbamoyl]imino}- 3- (1- phenylpropan- 2- yl)- 4,5- dihydro- 1,2,3- oxadiazol- 3- ium- 4- ide
Smiles: Brc1ccc(c(c1)Br)NC(=O)/N=C\1/ON=[N+]([C-]1Br)C(Cc1ccccc1)C

STK548129
Synonyms: N- benzyl- 2- [(4- oxo- 3- propyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)NCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548130
Synonyms: ethyl4- {[3- cyano- 6- methyl- 4- (thiophen- 3- yl)pyridin- 2- yl]sulfanyl}- 3- oxobutanoate
Smiles: CCOC(=O)CC(=O)CSc1nc(C)cc(c1C#N)c1cscc1

STK548131
Synonyms: 4- (4- butoxy- 6- methyl- 5- nitropyrimidin- 2- yl)morpholine
Smiles: CCCCOc1nc(nc(c1[N+](=O)[O-])C)N1CCOCC1

STK548132
Synonyms: 2- amino- 1- (4- ethoxyphenyl)- N- phenyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCOc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)Nc1ccccc1

STK548133
Synonyms: 4- [(8S,8aR,11aS)- 8- [(4- methoxyphenyl)carbonyl]- 9,11- dioxo- 8a,9,11a,11b- tetrahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinolin- 10(11H)- yl]phenylacetate
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2C2N1C=Cc1c2cccc1)c1ccc(cc1)OC(=O)C

STK548134
Synonyms: 5- bromo- N- (furan- 2- ylmethyl)- 2,3,4- trimethylbenzamide
Smiles: O=C(c1cc(Br)c(c(c1C)C)C)NCc1ccco1

STK548135
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 2- {[5- (4- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1Cl)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)Cl

STK548136
Synonyms: 3- butyl- 2- (hexylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCn1c(SCCCCCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548137
Synonyms: 2- (4- methoxyphenyl)- 3- [2- (2,3,6- trimethylphenoxy)ethyl]quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1c(C)ccc(c1C)C

STK548138
Synonyms: 5- amino- 6- (ethylsulfanyl)- 1- phenyl- 1,5- dihydro- 4H- pyrazolo[3,4- d]pyrimidin- 4- one
Smiles: CCSc1nc2n(ncc2c(=O)n1N)c1ccccc1

STK548140
Synonyms: 10- hexanoyl- 3- (4- methylphenyl)- 11- [4- (propan- 2- yloxy)phenyl]- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: CCCCCC(=O)N1C(c2ccc(cc2)OC(C)C)C2=C(Nc3c1cccc3)CC(CC2=O)c1ccc(cc1)C

STK548141
Synonyms: 2- [1- oxo- 1- (2,2,4,6,8- pentamethylquinolin- 1(2H)- yl)- 3- phenylpropan- 2- yl]- 1H- isoindole- 1,3(2H)- dione
Smiles: Cc1cc(C)c2c(c1)C(=CC(N2C(=O)C(N1C(=O)c2c(C1=O)cccc2)Cc1ccccc1)(C)C)C

STK548143
Synonyms: N- [4- (acetylamino)phenyl]- 2- [(3- butyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCCCn1c(SCC(=O)Nc2ccc(cc2)NC(=O)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548144
Synonyms: 4- {[3,6- bis(ethoxycarbonyl)quinolin- 4- yl]amino}benzoicacid
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(cc1)C(=O)O)cc(cc2)C(=O)OCC

STK548146
Synonyms: 4- [3- acetyl- 4- hydroxy- 2- (4- nitrophenyl)- 5- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl]butanoicacid
Smiles: OC(=O)CCCN1C(c2ccc(cc2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)C

STK548147
Synonyms: 5- (4- ethoxyphenyl)- 3- (4- methoxyphenyl)- 2,3a- diphenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: CCOc1ccc(cc1)N1C(=O)C2C(C1=O)(c1ccccc1)C(N(O2)c1ccccc1)c1ccc(cc1)OC

STK548148
Synonyms: 1- (4- methoxy- 6- methylpyrimidin- 2- yl)thiourea
Smiles: COc1cc(C)nc(n1)NC(=S)N

STK548151
Synonyms: 8- bromo- 1,3- dimethyl- 7- [2- (4- methylpiperidin- 1- yl)ethyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC1CCN(CC1)CCn1c(Br)nc2c1c(=O)n(C)c(=O)n2C

STK548152
Synonyms: ethyl3,3,3- trifluoro- 2- (pentanoylamino)- N- [6- (propan- 2- yl)- 1,3- benzothiazol- 2- yl]alaninate
Smiles: CCCCC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1nc2c(s1)cc(cc2)C(C)C

STK548154
Synonyms: 3- [3- (2,5- dichlorophenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cc(Cl)ccc1Cl

STK548155
Synonyms: propan- 2- yl2- amino- 1- (3- chloro- 4- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COc1ccc(cc1Cl)n1c2nc3ccccc3nc2c(c1N)C(=O)OC(C)C

STK548159
Synonyms: 4- {(E)- [2- ({1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(diethylamino)methyl]- 1H- 1,2,3- triazol- 4- yl}carbonyl)hydrazinylidene]methyl}- 2- methoxyphenyl4- chlorobenzoate
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(c(c1)OC)OC(=O)c1ccc(cc1)Cl)CC

STK548160
Synonyms: propan- 2- yl2- amino- 1- (3- chlorophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)Cl)C

STK548161
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: O=C1NC(=O)[C@H]2[C@@H]1[C@@H](C(=O)c1ccc(cc1)Cl)N1C2c2ccccc2C=C1

STK548162
Synonyms: 2- acetylphenyl2- (4- ethoxyphenyl)quinoline- 4- carboxylate
Smiles: CCOc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)Oc1ccccc1C(=O)C

STK548163
Synonyms: naphthalen- 1- yl2- chloroquinoline- 4- carboxylate
Smiles: Clc1nc2ccccc2c(c1)C(=O)Oc1cccc2c1cccc2

STK548165
Synonyms: 2- [(3- butyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N- (4- methylphenyl)acetamide
Smiles: CCCCn1c(SCC(=O)Nc2ccc(cc2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548166
Synonyms: [(4- bromophenyl)sulfonyl][3- (4- tert- butylpyridinium- 1- yl)- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl]azanide
Smiles: Brc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2ccc(cc2)C(C)(C)C)C(=O)c2c(C1=O)cccc2

STK548167
Synonyms: 3- [2- (2,5- dichlorophenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1cc(Cl)ccc1Cl

STK548168
Synonyms: 1- amino- N- (2- chlorophenyl)- 8,8- dimethyl- 5- (morpholin- 4- yl)- 8,9- dihydro- 6H- thieno[2,3- b]thiopyrano[4,3- d]pyridine- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c1CC(C)(C)SCc1c(n2)N1CCOCC1)Nc1ccccc1Cl

STK548169
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (3- chlorophenyl)methylidene]- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CC1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)Cl

STK548171
Synonyms: (5E)- 2- [4- (2- methylphenyl)piperazin- 1- yl]- 5- {2- [(4- nitrobenzyl)oxy]benzylidene}- 1,3- thiazol- 4(5H)- one
Smiles: O=C1N=C(S/C/1=C/c1ccccc1OCc1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)c1ccccc1C

STK548172
Synonyms: N- (2,4- dimethylphenyl)- 2- [(4- oxo- 3- phenyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCC3

STK548173
Synonyms: methyl[(2- phenyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)sulfanyl]acetate
Smiles: COC(=O)CSc1nc(nc2c1c1CCCCc1s2)c1ccccc1

STK548174
Synonyms: ethyl2- amino- 1- (4- {[(2E)- 3- phenylprop- 2- enoyl]amino}phenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccc(cc1)NC(=O)/C=C/c1ccccc1

STK548175
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- ethoxy- 4- [(3- fluorobenzyl)oxy]phenyl}methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)ccc1OCc1cccc(c1)F

STK548177
Synonyms: 1- benzyl- 2- imino- N,10- dimethyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: CNC(=O)c1cc2c(n(c1=N)Cc1ccccc1)nc1n(c2=O)cccc1C

STK548178
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (naphthalen- 2- yl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2C2N1C=Cc1c2cccc1)c1ccc2c(c1)cccc2

STK548179
Synonyms: (3E)- N- (3- chloro- 4- methoxyphenyl)- 3- {2- [(3- hydroxyphenyl)carbonyl]hydrazinylidene}butanamide
Smiles: COc1ccc(cc1Cl)NC(=O)C/C(=N/NC(=O)c1cccc(c1)O)/C

STK548180
Synonyms: 1- amino- 8,8- dimethyl- 5- (pyrrolidin- 1- yl)- 8,9- dihydro- 6H- pyrano[4,3- d]thieno[2,3- b]pyridine- 2- carbohydrazide
Smiles: NNC(=O)c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCCC1

STK548181
Synonyms: methyl2- [(8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 9,11- dioxo- 8a,9,11a,11b- tetrahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazin- 10(11H)- yl]benzoate
Smiles: COC(=O)c1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccc(cc2)Cl)N=Cc2c1cccc2

STK548182
Synonyms: 2- (benzylsulfanyl)- 5- [(4- nitrobenzyl)sulfanyl]- 1,3,4- thiadiazole
Smiles: [O-][N+](=O)c1ccc(cc1)CSc1nnc(s1)SCc1ccccc1

STK548183
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- [2- (4- sulfamoylphenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(cc1)S(=O)(=O)N)C

STK548185
Synonyms: ethyl6- methyl- 4- {[4- (propoxycarbonyl)phenyl]amino}quinoline- 3- carboxylate
Smiles: CCCOC(=O)c1ccc(cc1)Nc1c(cnc2c1cc(C)cc2)C(=O)OCC

STK548186
Synonyms: 4- methyl- 2- [(Z)- (3- oxo- 1- benzothiophen- 2(3H)- ylidene)methyl]phenyl2- nitrobenzoate
Smiles: Cc1ccc(c(c1)/C=C/1\Sc2c(C1=O)cccc2)OC(=O)c1ccccc1[N+](=O)[O-]

STK548187
Synonyms: N'- [(1E)- 8- methoxy- 4,4- dimethyl- 4,5- dihydro- 1H- [1,2]dithiolo[3,4- c]quinolin- 1- ylidene]pyridine- 4- carbohydrazide
Smiles: COc1ccc2c(c1)c1/c(=N\NC(=O)c3ccncc3)/ssc1C(N2)(C)C

STK548188
Synonyms: methyl3,3,3- trifluoro- N- [(4- fluorophenyl)carbonyl]- 2- ({5- [(4- nitrophenyl)sulfonyl]- 1,3- thiazol- 2- yl}amino)alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccc(cc1)F)Nc1ncc(s1)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

STK548189
Synonyms: 2- (2- fluorophenyl)- 4- (4- methylpiperazin- 1- yl)quinazoline
Smiles: CN1CCN(CC1)c1nc(nc2c1cccc2)c1ccccc1F

STK548190
Synonyms: 2- [(E)- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)methyl]- 6- methoxyphenylbenzoate
Smiles: COc1cccc(c1OC(=O)c1ccccc1)/C=N/NC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N

STK548191
Synonyms: N- {3- phenyl- 3- [4- (propan- 2- yloxy)phenyl]propyl}benzamide
Smiles: CC(Oc1ccc(cc1)C(c1ccccc1)CCNC(=O)c1ccccc1)C

STK548193
Synonyms: 3- [2- (4- chloro- 3,5- dimethylphenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1cc(C)c(c(c1)C)Cl

STK548194
Synonyms: 3- (2- phenylethyl)- 11- (tetrahydrofuran- 2- ylmethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: O=c1n(CCc2ccccc2)cnc2c1c1nc3ccccc3nc1n2CC1CCCO1

STK548195
Synonyms: N- (12- cyanoindolizino[2,3- b]quinoxalin- 2- yl)thiophene- 2- carboxamide
Smiles: N#Cc1c2cc(ccn2c2c1nc1ccccc1n2)NC(=O)c1cccs1

STK548196
Synonyms: N- {2- [(5- chloropyridin- 2- yl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}- 2- iodobenzamide
Smiles: Clc1ccc(nc1)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccccc1I

STK548199
Synonyms: 2- [(3,4- dichlorobenzyl)sulfanyl]- 3- (4- ethoxyphenyl)quinazolin- 4(3H)- one
Smiles: CCOc1ccc(cc1)n1c(SCc2ccc(c(c2)Cl)Cl)nc2c(c1=O)cccc2

STK548200
Synonyms: N'~1~- [(3E)- 5- bromo- 2- oxo- 1- (propan- 2- yl)- 1,2- dihydro- 3H- indol- 3- ylidene]- N'~7~- [(3Z)- 5- bromo- 2- oxo- 1- (propan- 2- yl)- 1,2- dihydro- 3H- indol- 3- ylidene]heptanedihydrazide
Smiles: CC(N1C(=O)/C(=N/NC(=O)CCCCCC(=O)N/N=C/2\C(=O)N(c3c2cc(Br)cc3)C(C)C)/c2c1ccc(c2)Br)C

STK548201
Synonyms: 4- methyl- 7- (2- {[2- (morpholin- 4- yl)ethyl]sulfanyl}ethoxy)- 2H- chromen- 2- one
Smiles: O=c1cc(C)c2c(o1)cc(cc2)OCCSCCN1CCOCC1

STK548202
Synonyms: N,N- dibutyl- 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3)CCCC

STK548204
Synonyms: 3- chloro- N- [1- (1- hexyl- 1H- benzimidazol- 2- yl)ethyl]benzamide
Smiles: CCCCCCn1c(nc2c1cccc2)C(NC(=O)c1cccc(c1)Cl)C

STK548205
Synonyms: 2- [(3- butyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N,N- dipropylacetamide
Smiles: CCCCn1c(SCC(=O)N(CCC)CCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548206
Synonyms: N- [(2- hydroxyquinolin- 3- yl)methyl]- 2- methoxy- N- (2- methylphenyl)benzamide
Smiles: COc1ccccc1C(=O)N(c1ccccc1C)Cc1cc2ccccc2nc1O

STK548207
Synonyms: methyl5- bromo- 3- [(phenylcarbonyl)amino]- 1- benzofuran- 2- carboxylate
Smiles: COC(=O)c1oc2c(c1NC(=O)c1ccccc1)cc(cc2)Br

STK548208
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [4- (naphthalen- 1- ylmethoxy)phenyl]methylidene}- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1c1ccccc1)c1nonc1N)N/N=C/c1ccc(cc1)OCc1cccc2c1cccc2

STK548209
Synonyms: 2- [(3,3- dimethylpiperidin- 1- yl)carbonyl]- 1- [(2- hydroxyethyl)amino]anthracene- 9,10- dione
Smiles: OCCNc1c(ccc2c1C(=O)c1ccccc1C2=O)C(=O)N1CCCC(C1)(C)C

STK548211
Synonyms: (2E)- N- (2- {(2Z)- 2- [1- (3- cyanopropyl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]hydrazinyl}- 2- oxoethyl)- 3- phenylprop- 2- enamide(non- preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)/C=C/c2ccccc2)/c2c1cccc2

STK548212
Synonyms: ethyl5- (acetyloxy)- 2- [(1,3- benzothiazol- 2- ylsulfanyl)methyl]- 6- bromo- 1- phenyl- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c(CSc2nc3c(s2)cccc3)n(c2c1cc(OC(=O)C)c(c2)Br)c1ccccc1

STK548213
Synonyms: ethyl2- ({[(2Z)- 3- (4- bromophenyl)prop- 2- enoyl]carbamothioyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)/C=C\c2ccc(cc2)Br)sc2c1CCCC2

STK548214
Synonyms: naphthalen- 1- yl2- (4- bromophenyl)- 8- methylquinoline- 4- carboxylate
Smiles: Brc1ccc(cc1)c1cc(C(=O)Oc2cccc3c2cccc3)c2c(n1)c(C)ccc2

STK548215
Synonyms: 1- (2- ethyl- 1H- benzimidazol- 1- yl)- 3- [5- methyl- 2- (propan- 2- yl)phenoxy]propan- 2- ol
Smiles: CCc1nc2c(n1CC(COc1cc(C)ccc1C(C)C)O)cccc2

STK548216
Synonyms: {methyl4- [3- {bis[2- (hydroxy- kappaO)ethyl]amino- kappaN}- 2- (hydroxy- kappaO)propoxy]benzoatato(3- )}boron
Smiles: COC(=O)c1ccc(cc1)OCC1O[B-]23[N+](C1)(CCO3)CCO2

STK548217
Synonyms: 9- (ethylsulfanyl)- 8- (2- methylprop- 2- en- 1- yl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CCSc1nc2sc3c(c2c(=O)n1CC(=C)C)CCc1c3cccc1

STK548218
Synonyms: (2E)- 2- {[8- (benzyloxy)quinolin- 2- yl]methylidene}hydrazinecarbothioamide
Smiles: NC(=S)N/N=C/c1ccc2c(n1)c(ccc2)OCc1ccccc1

STK548219
Synonyms: 3- [2- (2- bromophenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccccc1Br

STK548220
Synonyms: 11- (2- methoxyphenyl)- 10- methyl- N- (4- methylphenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1)C)c1ccccc1

STK548222
Synonyms: N- (diphenylmethyl)- 2- {[3- (2- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3

STK548224
Synonyms: (8S,8aR,11aS)- 8- [(3- nitrophenyl)carbonyl]- 10- phenyl- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: O=C([C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1)cccc3)c1cccc(c1)[N+](=O)[O-]

STK548225
Synonyms: 6- (4- chlorophenyl)- 8- phenyl- 3,4a,7a,8- tetrahydropyrrolo[3',4':5,6]thiopyrano[2,3- d][1,3]thiazole- 2,5,7(6H)- trione
Smiles: Clc1ccc(cc1)N1C(=O)C2C(C1=O)Sc1c(C2c2ccccc2)sc(=O)[nH]1

STK548226
Synonyms: ethyl4- {2- (2- fluorophenyl)- 4- hydroxy- 3- [(4- methoxyphenyl)carbonyl]- 5- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1F)C(=O)c1ccc(cc1)OC)O

STK548227
Synonyms: ethyl2- ({[(3- cyano- 4,5,6- trimethylpyridin- 2- yl)sulfanyl]acetyl}amino)- 5,6- dihydro- 4H- cyclopenta[b]thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc(C)c(c(c2C#N)C)C)sc2c1CCC2

STK548228
Synonyms: 4- ethyl- 2,6- bis(4- methoxyphenyl)- 9,10- diphenylhexahydro- 4,8- ethenopyrrolo[3,4- f]isoindole- 1,3,5,7(2H,6H)- tetrone
Smiles: COc1ccc(cc1)N1C(=O)C2C(C1=O)C1(CC)C3C(C2C(=C1c1ccccc1)c1ccccc1)C(=O)N(C3=O)c1ccc(cc1)OC

STK548230
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (4- bromophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)Br)C

STK548231
Synonyms: 3- (3,3- dimethylpiperidin- 1- yl)- 5- [(2- methylphenyl)amino]- 6H- anthra[1,9- cd][1,2]oxazol- 6- one
Smiles: Cc1ccccc1Nc1cc(N2CCCC(C2)(C)C)c2c3c1C(=O)c1ccccc1c3on2

STK548232
Synonyms: N'- [(1E)- 1- (4- chlorophenyl)ethylidene]- 2- [(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(s1)C)N/N=C(/c1ccc(cc1)Cl)\C

STK548233
Synonyms: ethyl4- cyano- 5- [({[3- cyano- 4- (4- methoxyphenyl)- 5,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}acetyl)amino]- 3- methylthiophene- 2- carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)NC(=O)CSc1nc2CCCCc2c(c1C#N)c1ccc(cc1)OC

STK548236
Synonyms: 3- (2- chlorophenyl)- 8- [(dimethylamino)methyl]- 7- hydroxy- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CN(Cc1c(O)ccc2c1oc(c(c2=O)c1ccccc1Cl)C(F)(F)F)C

STK548237
Synonyms: 2- {[(tricyclo[4.3.1.1~3,8~]undec- 3- ylmethyl)amino]methyl}phenol
Smiles: Oc1ccccc1CNCC12CCC3CC(C1)CC(C2)C3

STK548238
Synonyms: 2- (2,4- dioxo- 3- phenyl- 1,3- thiazolidin- 5- yl)- N- [(3- methylphenyl)carbamothioyl]acetamide
Smiles: O=C(CC1SC(=O)N(C1=O)c1ccccc1)NC(=S)Nc1cccc(c1)C

STK548240
Synonyms: 4- acetyl- 3- hydroxy- 1- (4- methoxyphenyl)- 5- (4- nitrophenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)N1C(=O)C(=C(C1c1ccc(cc1)[N+](=O)[O-])C(=O)C)O

STK548242
Synonyms: (4Z)- 2- (4- chloro- 3- nitrophenyl)- 4- ({5- [3- (trifluoromethyl)phenyl]furan- 2- yl}methylidene)- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C\c1ccc(o1)c1cccc(c1)C(F)(F)F)c1ccc(c(c1)[N+](=O)[O-])Cl

STK548243
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 10- methyl- 8- phenyl- 11- (thiophen- 2- yl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(cc1Cl)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccs2)c(nn1c1ccccc1)C

STK548245
Synonyms: 2- amino- 1- (3,5- dichlorophenyl)- N- phenyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Clc1cc(Cl)cc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)Nc1ccccc1

STK548247
Synonyms: ethyl5- bromo- 3- [(3,3- diphenylpropanoyl)amino]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CC(c1ccccc1)c1ccccc1)cc(cc2)Br

STK548248
Synonyms: methyl3,3,3- trifluoro- N- [(2- methylphenyl)carbonyl]- 2- ({5- [(4- nitrophenyl)sulfonyl]- 1,3- thiazol- 2- yl}amino)alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1C)Nc1ncc(s1)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

STK548249
Synonyms: 4- [(4- chlorophenyl)carbonyl]- 1- (4- fluorophenyl)- 3- hydroxy- 5- (3- nitrophenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Fc1ccc(cc1)N1C(=O)C(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)c1ccc(cc1)Cl)O

STK548251
Synonyms: 11- (4- ethoxyphenyl)- 3- (furan- 2- ylmethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCOc1ccc(cc1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)Cc1ccco1

STK548252
Synonyms: N- [4- (acetylamino)phenyl]- 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3

STK548253
Synonyms: (8S,8aR,11aS)- 10- (2- chlorophenyl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1Cl)cccc3

STK548254
Synonyms: 9- {[(2E)- 3- chlorobut- 2- en- 1- yl]sulfanyl}- 8- (2- methylprop- 2- en- 1- yl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CC(=C)Cn1c(SC/C=C(/Cl)\C)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK548255
Synonyms: 2- cyano- N'- [(4E)- 1,2,5- trimethylpiperidin- 4- ylidene]acetohydrazide
Smiles: CC1CN(C)C(C/C/1=N\NC(=O)CC#N)C

STK548257
Synonyms: ethyl2- [({[3- cyano- 6- methyl- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydro- 1,6- naphthyridin- 2- yl]sulfanyl}acetyl)amino]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc3CCN(Cc3c(c2C#N)c2cccs2)C)sc2c1CCCC2

STK548258
Synonyms: ethyl4- {[3- cyano- 4- (2- methoxyphenyl)- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}- 3- oxobutanoate
Smiles: CCOC(=O)CC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccccc1OC

STK548259
Synonyms: diethyl4- (naphthalen- 1- ylamino)quinoline- 3,6- dicarboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1cccc3c1cccc3)cc(cc2)C(=O)OCC

STK548260
Synonyms: 2- phenyl- 4- (propan- 2- ylsulfanyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine
Smiles: CC(Sc1nc(nc2c1c1CCCCc1s2)c1ccccc1)C

STK548261
Synonyms: propan- 2- yl2- amino- 1- (2- chlorobenzyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CC(OC(=O)c1c2nc3ccccc3nc2n(c1N)Cc1ccccc1Cl)C

STK548263
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- N'- {(E)- [5- (3- nitrophenyl)furan- 2- yl]methylidene}- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)N/N=C/c1ccc(o1)c1cccc(c1)[N+](=O)[O-]

STK548264
Synonyms: ethyl2- {[(2- chlorophenyl)carbonyl]amino}- 1- (2- methylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccccc2Cl)n(c2c1nc1ccccc1n2)c1ccccc1C

STK548265
Synonyms: N- {(E)- [4- (3- methylbutoxy)phenyl]methylidene}- 1- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)ethanamine
Smiles: CC(C12CC3CC(C2)CC(C1)C3)/N=C/c1ccc(cc1)OCCC(C)C

STK548266
Synonyms: 2- {[6- iodo- 3- (4- methylphenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}- N- (2- methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2ccc(cc2c(=O)n1c1ccc(cc1)C)I

STK548267
Synonyms: prop- 2- en- 1- yl2- amino- 1- butyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)OCC=C

STK548268
Synonyms: ethyl4- [2- (4- fluorophenyl)- 4- hydroxy- 5- oxo- 3- (phenylcarbonyl)- 2,5- dihydro- 1H- pyrrol- 1- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(c2ccc(cc2)F)C(=C(C1=O)O)C(=O)c1ccccc1

STK548269
Synonyms: 2- methoxyethyl2- amino- 1- (3- butoxypropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCOCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)OCCOC

STK548270
Synonyms: ethyl4- ({[2- amino- 1- (3,5- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK548271
Synonyms: 2- [2- (4- methylpiperazin- 1- yl)- 2- oxoethyl]- 4- [4- methyl- 3- (piperidin- 1- ylsulfonyl)phenyl]phthalazin- 1(2H)- one
Smiles: CN1CCN(CC1)C(=O)Cn1nc(c2ccc(c(c2)S(=O)(=O)N2CCCCC2)C)c2c(c1=O)cccc2

STK548272
Synonyms: 5- (4- nitrophenyl)- 1- [3- (trifluoromethyl)phenyl]- 3- {[3- (trifluoromethyl)phenyl]amino}- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: O=C1C(=CC(N1c1cccc(c1)C(F)(F)F)c1ccc(cc1)[N+](=O)[O-])Nc1cccc(c1)C(F)(F)F

STK548273
Synonyms: N- (3- chloro- 4- fluorophenyl)- 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)F)c1ccccc1

STK548274
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]- N- (4- methoxyphenyl)acetamide
Smiles: CCc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)OC)nn2)CC(OC3)(C)C

STK548275
Synonyms: prop- 2- en- 1- ylcyano[3- (4- methylpiperazin- 1- yl)quinoxalin- 2- yl]acetate
Smiles: C=CCOC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)C)C#N

STK548276
Synonyms: 2- cyano- N- (1- phenylethyl)- 2- [3- (piperidin- 1- yl)quinoxalin- 2- yl]acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCCCC1)C(=O)NC(c1ccccc1)C

STK548277
Synonyms: 5- methyl- 2- (propan- 2- yl)cyclohexyl[(2,4- dichlorophenyl)(hydroxy)methyl][4- (dimethylamino)phenyl]phosphinate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccc(cc1Cl)Cl)O)c1ccc(cc1)N(C)C)C(C)C

STK548278
Synonyms: ethyl(1R,2S,3S)- 3- [(4- chlorophenyl)carbamoyl]- 1- cyano- 2- phenyl- 1,2,3,10b- tetrahydropyrrolo[2,1- a]isoquinoline- 1- carboxylate
Smiles: CCOC(=O)[C@]1(C#N)[C@H](c2ccccc2)[C@H](N2C1c1ccccc1C=C2)C(=O)Nc1ccc(cc1)Cl

STK548279
Synonyms: methyl2- amino- 1- (4- pentylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCCc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)OC

STK548280
Synonyms: 11- {4- [(4- chlorobenzyl)oxy]- 3- ethoxyphenyl}- 3- (4- methoxyphenyl)- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)Cl)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)OC

STK548281
Synonyms: ethyl(2E,3E)- 3- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)- 2- (hydroxyimino)butanoate
Smiles: CCOC(=O)/C(=N/O)/C(=N/NC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)/C

STK548283
Synonyms: N'- [(E)- (4- hydroxyphenyl)methylidene]- 4- [(2- methylbenzo[h]quinolin- 4- yl)amino]benzohydrazide
Smiles: Oc1ccc(cc1)/C=N/NC(=O)c1ccc(cc1)Nc1cc(C)nc2c1ccc1c2cccc1

STK548284
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- [(3- chlorobenzyl)oxy]phenyl}methylidene]- 5- [(diethylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)OCc1cccc(c1)Cl)CC

STK548286
Synonyms: propan- 2- yl2- amino- 1- (1- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CC(OC(=O)c1c2nc3ccccc3nc2n(c1N)C(c1ccccc1)C)C

STK548288
Synonyms: (9E)- 3- (4- bromophenyl)- 9- (2,4- dichlorobenzylidene)- 5- (2,4- dichlorophenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: Clc1ccc(c(c1)Cl)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Br)/C(=C/c1ccc(cc1Cl)Cl)/CCC2

STK548289
Synonyms: methyl2- ({(2Z)- 2- cyano- 3- [4- (propan- 2- yl)phenyl]prop- 2- enoyl}amino)- 5,6- dihydro- 4H- cyclopenta[b]thiophene- 3- carboxylate
Smiles: N#C/C(=C/c1ccc(cc1)C(C)C)/C(=O)Nc1sc2c(c1C(=O)OC)CCC2

STK548290
Synonyms: N- [1- (1H- benzimidazol- 2- yl)butyl]- 3,5- dinitrobenzamide
Smiles: CCCC(c1nc2c([nH]1)cccc2)NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]

STK548291
Synonyms: 4- fluoro- N- (2- methoxyphenazin- 1- yl)benzamide
Smiles: COc1ccc2c(c1NC(=O)c1ccc(cc1)F)nc1c(n2)cccc1

STK548292
Synonyms: N- (2,5- dimethylphenyl)- 11- (4- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Fc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cc(C)ccc1C)nc1c2cccc1

STK548293
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(2- fluorobenzyl)oxy]- 3- methoxyphenyl}methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)ccc1OCc1ccccc1F

STK548294
Synonyms: 2- methoxyethyl2- amino- 1- (3,4- dichlorophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)Cl

STK548295
Synonyms: 1- (1,3- benzodioxol- 5- yl)- 2- {[4- (4- chlorophenyl)- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}ethanone
Smiles: Clc1ccc(cc1)n1c(SCC(=O)c2ccc3c(c2)OCO3)nnc1c1ccncc1

STK548296
Synonyms: (3aR,4S,9aR,9bS)- 4- [(4- chlorophenyl)carbonyl]- 2- (3,5- dichlorophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(Cl)cc(c1)Cl)C(=O)c1ccccc1

STK548297
Synonyms: 3- [(Z)- (3- cyclopentyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 2- [4- (2- hydroxyethyl)piperazin- 1- yl]- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: OCCN1CCN(CC1)c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCCC1

STK548299
Synonyms: 4- bromo- 2- {(E)- [(5- bromopyridin- 2- yl)imino]methyl}naphthalen- 1- ol
Smiles: Brc1ccc(nc1)/N=C/c1cc(Br)c2c(c1O)cccc2

STK548300
Synonyms: 4- bromo- N- (2- {(2Z)- 2- [1- (3- cyanopropyl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]hydrazinyl}- 2- oxoethyl)benzamide(non- preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)c2ccc(cc2)Br)/c2c1cccc2

STK548301
Synonyms: 3- [2- (cyclohex- 1- en- 1- yl)ethyl]- 6- hydroxy- 5- (1,2,3,4- tetrahydroisoquinolin- 1- yl)- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: Oc1[nH]c(=S)n(c(=O)c1C1NCCc2c1cccc2)CCC1=CCCCC1

STK548302
Synonyms: 6- iodo- 3- methyl- 2- sulfanylquinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)S)C

STK548304
Synonyms: N- (2,4- dimethylphenyl)- 10- methyl- 8- phenyl- 11- [4- (propan- 2- yl)phenyl]- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1ccc(c(c1)C)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)C(C)C)C)c1ccccc1

STK548305
Synonyms: 2- [4- (benzyloxy)- 3- methoxyphenyl]- 1H- phenanthro[9,10- d]imidazole
Smiles: COc1cc(ccc1OCc1ccccc1)c1nc2c([nH]1)c1ccccc1c1c2cccc1

STK548306
Synonyms: (3aR,4S,9aR,9bS)- 4- [(3- bromo- 4- methoxyphenyl)carbonyl]- 2- (4- chlorophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)Cl)C(=O)c1ccccc1

STK548307
Synonyms: 2- {[4- oxo- 3- (prop- 2- en- 1- yl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N,N- dipropylacetamide
Smiles: C=CCn1c(SCC(=O)N(CCC)CCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548309
Synonyms: 4- (phenylcarbonyl)phenyl(6aS,6bR,9aS,10R)- 8- (naphthalen- 1- yl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxylate
Smiles: O=C([C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1cccc3c1cccc3)C=Cc1c2cccc1)Oc1ccc(cc1)C(=O)c1ccccc1

STK548310
Synonyms: 2- (4- methoxyphenyl)- 3- (3- {2- methoxy- 4- [(1E)- prop- 1- en- 1- yl]phenoxy}propyl)quinazolin- 4(3H)- one
Smiles: C/C=C/c1ccc(c(c1)OC)OCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STK548311
Synonyms: 6- (azepan- 1- yl)- N,N'- bis(2- chloro- 5- methoxyphenyl)- 1,3,5- triazine- 2,4- diamine
Smiles: COc1ccc(c(c1)Nc1nc(nc(n1)N1CCCCCC1)Nc1cc(OC)ccc1Cl)Cl

STK548312
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- phenoxyphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Oc1ccccc1)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1

STK548313
Synonyms: N- (2,4- dimethylphenyl)- 2- [(6,6- dimethyl- 2- phenyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nc(nc2c1c1CC(C)(C)OCc1s2)c1ccccc1

STK548314
Synonyms: 3- hexyl- 11- (4- methoxybenzyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccc(cc1)OC

STK548315
Synonyms: N- (3,5- dichlorophenyl)- 2- (2- fluorophenyl)quinazolin- 4- amine
Smiles: Clc1cc(Cl)cc(c1)Nc1nc(nc2c1cccc2)c1ccccc1F

STK548316
Synonyms: 2- [(4- amino- 6,8- diphenyl- 5,8- dihydro- 6H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- 1- (4- bromophenyl)ethanone
Smiles: Brc1ccc(cc1)C(=O)CSc1nc(N)c2c(n1)sc1c2CC(SC1c1ccccc1)c1ccccc1

STK548318
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(1E)- 1- phenylethylidene]- 5- (piperidin- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCCCC1)c1nonc1N)N/N=C(/c1ccccc1)\C

STK548322
Synonyms: 3- (4- bromophenyl)- 5- (3- chloro- 4- methylphenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: Brc1ccc(cc1)C1C2C(=O)N(C(=O)C2ON1c1ccccc1)c1ccc(c(c1)Cl)C

STK548323
Synonyms: ethyl2- [({[3- cyano- 4- (4- methoxyphenyl)- 6,7- dihydro- 5H- cyclopenta[b]pyridin- 2- yl]sulfanyl}acetyl)amino]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc3CCCc3c(c2C#N)c2ccc(cc2)OC)sc2c1CCCC2

STK548324
Synonyms: 2- {[3- cyano- 6- (4- methoxyphenyl)- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (2,5- dimethoxyphenyl)acetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)Nc2cc(OC)ccc2OC)c(c(c1)c1cccs1)C#N

STK548325
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (4- butoxyphenyl)methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCCCOc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK548327
Synonyms: 4- (4- benzylpiperazin- 1- yl)- 5- (biphenyl- 4- yl)thieno[2,3- d]pyrimidine
Smiles: c1ccc(cc1)CN1CCN(CC1)c1ncnc2c1c(cs2)c1ccc(cc1)c1ccccc1

STK548329
Synonyms: [3- (4- {[(2- chlorophenyl)carbonyl]amino}pyridinium- 1- yl)quinoxalin- 2- yl](phenylsulfonyl)azanide
Smiles: O=C(c1ccccc1Cl)Nc1cc[n+](cc1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccccc1

STK548330
Synonyms: 5- (4- bromophenyl)- 1- [3- (trifluoromethyl)phenyl]- 3- {[3- (trifluoromethyl)phenyl]amino}- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Brc1ccc(cc1)C1C=C(C(=O)N1c1cccc(c1)C(F)(F)F)Nc1cccc(c1)C(F)(F)F

STK548331
Synonyms: N- (naphthalen- 2- yl)- 4- [4- (prop- 2- yn- 1- yloxy)phenyl]phthalazin- 1- amine
Smiles: C#CCOc1ccc(cc1)c1nnc(c2c1cccc2)Nc1ccc2c(c1)cccc2

STK548332
Synonyms: 2- (3- bromo- 4- fluorophenyl)- 1H- phenanthro[9,10- d]imidazole
Smiles: Fc1ccc(cc1Br)c1nc2c([nH]1)c1ccccc1c1c2cccc1

STK548333
Synonyms: ethyl5- (3,5- dimethylphenyl)- 4,6- dioxo- 1,3a,4,5,6,6a- hexahydropyrrolo[3,4- c]pyrazole- 3- carboxylate
Smiles: CCOC(=O)C1=NNC2C1C(=O)N(C2=O)c1cc(C)cc(c1)C

STK548334
Synonyms: N,N- diethyl- N'- (7- methyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)propane- 1,3- diamine
Smiles: CCN(CCCNc1ncnc2c1c1CCC(Cc1s2)C)CC

STK548335
Synonyms: 2- [(3- butyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N- (2- methoxyphenyl)acetamide
Smiles: CCCCn1c(SCC(=O)Nc2ccccc2OC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548336
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (3- methoxypropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCCn1c2nc3ccccc3nc2c(c1N)C(=O)OC(COC)C

STK548337
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N- (3,4- difluorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CSc1nnc(s1)SCc1ccccc1

STK548338
Synonyms: 3- {[(2E)- 3- chlorobut- 2- en- 1- yl]sulfanyl}- 5- (ethylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCSc1nc2sc3c(c2c2n1c(SC/C=C(/Cl)\C)nn2)CCCC3

STK548339
Synonyms: 1- (4- bromophenyl)- 3- hydroxy- 5- phenyl- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Brc1ccc(cc1)N1C(c2ccccc2)C(=C(C1=O)O)C(=O)c1ccccc1

STK548341
Synonyms: 2- methoxyethyl2- amino- 1- benzyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccccc1

STK548342
Synonyms: [(4- chlorophenyl)sulfonyl][3- (piperidin- 1- yl)quinoxalin- 2- yl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)Cl)c1nc2ccccc2nc1N1CCCCC1

STK548343
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (3,5- dichloro- 2- methoxyphenyl)methylidene]- 5- methyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1c(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)cc(cc1Cl)Cl

STK548344
Synonyms: 2- [(2,6- dichlorophenyl)amino]- 4- methyl- N- phenyl- 1,3- thiazole- 5- carboxamide
Smiles: Cc1nc(sc1C(=O)Nc1ccccc1)Nc1c(Cl)cccc1Cl

STK548345
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (3- fluorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)F)cccc3

STK548346
Synonyms: 2- amino- N- (3,5- dimethylphenyl)- 1- (3- methylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Cc1cc(C)cc(c1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)C

STK548348
Synonyms: (5Z)- 5- [(1- methyl- 1H- indol- 3- yl)methylidene]- 1- (2- phenylethyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)/C(=C/c2cn(c3c2cccc3)C)/C(=O)N1CCc1ccccc1

STK548349
Synonyms: N- (4- methylphenyl)- 2- ({5- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(s1)SCc1cccc2c1cccc2

STK548350
Synonyms: [3- (4- benzylpyridinium- 1- yl)quinoxalin- 2- yl][(5- bromothiophen- 2- yl)sulfonyl]azanide
Smiles: Brc1ccc(s1)S(=O)(=O)[N-]c1nc2ccccc2nc1[n+]1ccc(cc1)Cc1ccccc1

STK548351
Synonyms: 11- (3,4- dichlorophenyl)- 3- (2- phenylethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Clc1ccc(cc1Cl)n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)CCc1ccccc1

STK548352
Synonyms: methyl1- [4- (acetylamino)phenyl]- 2- amino- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)NC(=O)C

STK548354
Synonyms: {3- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]quinoxalin- 2- yl}[(4- chlorophenyl)sulfonyl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)Cl)c1nc2ccccc2nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK548355
Synonyms: N- ethyl- 5- (4- {[4- methoxy- 3- (piperidin- 1- ylcarbonyl)phenyl]amino}phthalazin- 1- yl)- 2- methylbenzenesulfonamide
Smiles: CCNS(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)Nc1ccc(c(c1)C(=O)N1CCCCC1)OC

STK548356
Synonyms: ethyl6- bromo- 2,4- bis[(dimethylamino)methyl]- 5- hydroxy- 1- methyl- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c2c(CN(C)C)c(O)c(cc2n(c1CN(C)C)C)Br

STK548357
Synonyms: N- [3- cyano- 1- (2- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl]- 4- nitrobenzenesulfonamide
Smiles: N#Cc1c(NS(=O)(=O)c2ccc(cc2)[N+](=O)[O-])n(c2c1nc1ccccc1n2)c1ccccc1OC

STK548358
Synonyms: N- (2,4- dimethoxyphenyl)- 10- methyl- 8,11- diphenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(c(c1)OC)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccccc2)c(nn1c1ccccc1)C

STK548359
Synonyms: 11- {4- [(4- chlorobenzyl)oxy]- 3- ethoxyphenyl}- 3- (4- chlorophenyl)- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)Cl)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl

STK548361
Synonyms: 9- (4- chlorophenyl)- 2- (4- ethylphenyl)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)Cl)CCC1

STK548362
Synonyms: 1- (4- acetylphenyl)- 4- [(4- chlorophenyl)carbonyl]- 3- hydroxy- 5- (3- nitrophenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1ccc(cc1)C(=O)C

STK548365
Synonyms: 4- {4- (4- chlorophenyl)- 5- [(3- methoxybenzyl)sulfanyl]- 4H- 1,2,4- triazol- 3- yl}pyridine
Smiles: COc1cccc(c1)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1

STK548366
Synonyms: 2- (trifluoromethyl)benzylN'- cyano- N- (4- ethoxyphenyl)carbamimidothioate
Smiles: CCOc1ccc(cc1)N/C(=N/C#N)/SCc1ccccc1C(F)(F)F

STK548367
Synonyms: (3aR,4S,9aR,9bS)- 4- [(3- bromo- 4- methoxyphenyl)carbonyl]- 2- (2- fluorophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1F)C(=O)c1ccccc1

STK548368
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- [(4,5- dihydro- 1,3- thiazol- 2- ylsulfanyl)methyl]- 4- methoxyphenyl}methylidene]- 5- (piperidin- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1ccc(cc1CSC1=NCCS1)/C=N/NC(=O)c1nnn(c1CN1CCCCC1)c1nonc1N

STK548370
Synonyms: 3- (3,4- dimethylphenyl)- 6- hydroxy- 5- (1,2,3,4- tetrahydroisoquinolin- 1- yl)pyrimidine- 2,4(1H,3H)- dione
Smiles: Cc1ccc(cc1C)n1c(=O)[nH]c(c(c1=O)C1NCCc2c1cccc2)O

STK548373
Synonyms: (5E)- 2- [4- (2- methylphenyl)piperazin- 1- yl]- 5- (thiophen- 2- ylmethylidene)- 1,3- thiazol- 4(5H)- one
Smiles: O=C1N=C(S/C/1=C/c1cccs1)N1CCN(CC1)c1ccccc1C

STK548375
Synonyms: 6- (2- methylbutan- 2- yl)- N- [3- (morpholin- 4- yl)propyl]- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- amine
Smiles: CCC(C1CCc2c(C1)c1c(NCCCN3CCOCC3)ncnc1s2)(C)C

STK548376
Synonyms: {3- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]quinoxalin- 2- yl}[(4- methylphenyl)sulfonyl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)C)c1nc2ccccc2nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK548377
Synonyms: 4- bromo- N- {3- [(4- methylphenyl)sulfonyl]- 1- (prop- 2- en- 1- yl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}benzenesulfonamide
Smiles: C=CCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)Br)S(=O)(=O)c1ccc(cc1)C

STK548378
Synonyms: 2- imino- 1,10- dimethyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carbonitrile
Smiles: N#Cc1cc2c(n(c1=N)C)nc1n(c2=O)cccc1C

STK548379
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (2- methoxybenzyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c2nc3ccccc3nc2n(c1N)Cc1ccccc1OC)C

STK548381
Synonyms: 9- (butylsulfanyl)- 8- (2- methylprop- 2- en- 1- yl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CCCCSc1nc2sc3c(c2c(=O)n1CC(=C)C)CCc1c3cccc1

STK548382
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- [(2- chlorobenzyl)oxy]phenyl}methylidene]- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Nc1nonc1n1nnc(c1CN1CCc2c1cccc2)C(=O)N/N=C/c1cccc(c1)OCc1ccccc1Cl

STK548383
Synonyms: 5- (2,4- dimethoxyphenyl)- 3- hydroxy- 1- (4- nitrophenyl)- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(c(c1)OC)C1C(=C(C(=O)N1c1ccc(cc1)[N+](=O)[O-])O)C(=O)c1ccccc1

STK548384
Synonyms: 5- iodo- N- (2,2,6,6- tetramethylpiperidin- 4- yl)furan- 2- carboxamide
Smiles: O=C(c1ccc(o1)I)NC1CC(C)(C)NC(C1)(C)C

STK548385
Synonyms: ethyl2- {[(3- amino- 5- oxo- 5,6,7,8- tetrahydrothieno[2,3- b]quinolin- 2- yl)carbonyl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(sc2c1CCCC2)NC(=O)c1sc2c(c1N)cc1c(n2)CCCC1=O

STK548386
Synonyms: (2E)- 2- (1,3- benzothiazol- 2(3H)- ylidene)- 4- (1,3- benzoxazol- 2- ylsulfanyl)- 3- oxobutanenitrile
Smiles: N#C/C(=c/1\sc2c([nH]1)cccc2)/C(=O)CSc1nc2c(o1)cccc2

STK548387
Synonyms: (8S,8aR,11aS)- 10- (naphthalen- 2- yl)- 8- (phenylcarbonyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: O=C([C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2C2N1N=Cc1c2cccc1)c1ccc2c(c1)cccc2)c1ccccc1

STK548388
Synonyms: 3- [2- (4- fluorophenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(cc1)F

STK548389
Synonyms: 2- benzyl- 1- (3,4- dimethoxybenzyl)- 1H- benzimidazole
Smiles: COc1cc(ccc1OC)Cn1c(Cc2ccccc2)nc2c1cccc2

STK548390
Synonyms: 2- {[3- cyano- 6- (thiophen- 2- yl)- 4- (trifluoromethyl)pyridin- 2- yl]sulfanyl}- N- (4- fluorobenzyl)acetamide
Smiles: N#Cc1c(SCC(=O)NCc2ccc(cc2)F)nc(cc1C(F)(F)F)c1cccs1

STK548391
Synonyms: ethyl4- [3- (2- butoxy- 1- cyano- 2- oxoethyl)quinoxalin- 2- yl]piperazine- 1- carboxylate
Smiles: CCCCOC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)C(=O)OCC)C#N

STK548392
Synonyms: 3- bromo- 1,7- bis(bromomethyl)- 7- methylbicyclo[2.2.1]heptan- 2- one
Smiles: BrCC12CCC(C2(C)CBr)C(C1=O)Br

STK548393
Synonyms: 7- tert- butyl- 2- (ethylsulfanyl)- 3- (3- methylphenyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: CCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCC(C3)C(C)(C)C

STK548394
Synonyms: 8- (2- methylprop- 2- en- 1- yl)- 9- [(2- oxo- 2- phenylethyl)sulfanyl]- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CC(=C)Cn1c(SCC(=O)c2ccccc2)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK548395
Synonyms: N'- [(3Z)- 2- oxo- 1- (prop- 2- yn- 1- yl)- 1,2- dihydro- 3H- indol- 3- ylidene]pyridine- 4- carbohydrazide
Smiles: C#CCN1c2ccccc2/C(=N/NC(=O)c2ccncc2)/C1=O

STK548396
Synonyms: (2'S,3'R)- 2'- (2,4- dichlorophenyl)- 3'- (phenylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indene- 2,1'- pyrrolo[2,1- a]phthalazine]- 1,3- dione
Smiles: Clc1ccc(c(c1)Cl)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2

STK548397
Synonyms: 8- {[bis(2- methoxyethyl)amino]methyl}- 3- (3,5- dimethylphenoxy)- 7- hydroxy- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: COCCN(Cc1c(O)ccc2c1oc(c(c2=O)Oc1cc(C)cc(c1)C)C(F)(F)F)CCOC

STK548398
Synonyms: 4- [(E)- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (piperidin- 1- ylmethyl)- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)methyl]- 2- methoxyphenylbenzoate
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCCCC2)c2nonc2N)ccc1OC(=O)c1ccccc1

STK548400
Synonyms: 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3

STK548401
Synonyms: N- {2- [(3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}- 2- methoxybenzamide
Smiles: COc1ccccc1C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1sc2c(c1C#N)CCCC2

STK548402
Synonyms: 4- {6- [(3,5- 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)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cc(C)cc(c1)C)nc1c2cccc1

STK548404
Synonyms: 3- [(3- methylbutyl)sulfanyl]- 5- phenyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CC(CCSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1)C

STK548405
Synonyms: ethyl4- (2- hydroxynaphthalen- 1- yl)- 1,6- dimethyl- 2- oxo- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1=C(C)N(C)C(=O)NC1c1c(O)ccc2c1cccc2

STK548406
Synonyms: N- ({2- [(5- chloro- 2- methoxyphenyl)carbonyl]hydrazinyl}carbonothioyl)- 3- (2,6- dichlorophenyl)- 5- methyl- 1,2- oxazole- 4- carboxamide
Smiles: COc1ccc(cc1C(=O)NNC(=S)NC(=O)c1c(C)onc1c1c(Cl)cccc1Cl)Cl

STK548407
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 8- methoxy- N- methyl- 5H- pyrimido[5,4- b]indol- 4- amine
Smiles: COc1ccc2c(c1)c1ncnc(c1[nH]2)N(CCc1ccc(c(c1)OC)OC)C

STK548408
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(4- methylpiperazin- 1- yl)methyl]- N'- {(1E)- 1- [3- (2H- tetrazol- 2- yl)phenyl]ethylidene}- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CN1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1cccc(c1)n1nncn1)\C

STK548410
Synonyms: 1- benzyl- 3- (4- benzylpiperazin- 1- yl)- 4- chloro- 1H- pyrrole- 2,5- dione
Smiles: ClC1=C(N2CCN(CC2)Cc2ccccc2)C(=O)N(C1=O)Cc1ccccc1

STK548411
Synonyms: 3- amino- N- (2- ethoxyphenyl)- 6- ethyl- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: CCOc1ccccc1NC(=O)c1sc2c(c1N)cc1c(n2)CCC(C1)CC

STK548414
Synonyms: [3- (4- benzylpiperidin- 1- yl)quinoxalin- 2- yl][(4- methylphenyl)sulfonyl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)C)c1nc2ccccc2nc1N1CCC(CC1)Cc1ccccc1

STK548416
Synonyms: ethyl2- ({[(3- cyano- 6,7,8,9- tetrahydro- 5H- cyclohepta[b]pyridin- 2- yl)sulfanyl]acetyl}amino)- 5,6- dihydro- 4H- cyclopenta[b]thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nc3CCCCCc3cc2C#N)sc2c1CCC2

STK548417
Synonyms: 2- (benzylsulfanyl)- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCn1c(SCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548418
Synonyms: 4- amino- N'- [(1E)- 1- (1,3- benzodioxol- 5- yl)ethylidene]- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: C/C(=N\N=C(\c1nonc1N)/N)/c1ccc2c(c1)OCO2

STK548419
Synonyms: (4- chlorophenyl)[4- (6- nitro- 4- phenylquinazolin- 2- yl)piperazin- 1- yl]methanone
Smiles: Clc1ccc(cc1)C(=O)N1CCN(CC1)c1nc2ccc(cc2c(n1)c1ccccc1)[N+](=O)[O-]

STK548420
Synonyms: 4- nitro- 5- (quinolin- 5- ylamino)benzene- 1,2- dicarbonitrile
Smiles: N#Cc1cc(Nc2cccc3c2cccn3)c(cc1C#N)[N+](=O)[O-]

STK548422
Synonyms: N'- [(3E)- 2- oxo- 1- (prop- 2- yn- 1- yl)- 1,2- dihydro- 3H- indol- 3- ylidene]- 2- phenylacetohydrazide
Smiles: C#CCN1c2ccccc2/C(=N\NC(=O)Cc2ccccc2)/C1=O

STK548424
Synonyms: (3Z)- 1- (2- bromoethyl)- 3- [2- (quinolin- 2- yl)hydrazinylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: BrCCN1C(=O)/C(=N\Nc2ccc3c(n2)cccc3)/c2c1cccc2

STK548426
Synonyms: 5- amino- 1- phenyl- 6- (propylsulfanyl)- 1,5- dihydro- 4H- pyrazolo[3,4- d]pyrimidin- 4- one
Smiles: CCCSc1nc2n(ncc2c(=O)n1N)c1ccccc1

STK548427
Synonyms: 1- (3- {[(4- bromophenyl)sulfonyl]amino}- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl)piperidine- 4- carboxamide
Smiles: Brc1ccc(cc1)S(=O)(=O)NC1=C(N2CCC(CC2)C(=O)N)C(=O)c2c(C1=O)cccc2

STK548429
Synonyms: 11- benzyl- 3- (4- ethoxyphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCOc1ccc(cc1)n1cnc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccccc1

STK548430
Synonyms: 11- {4- [(4- chlorobenzyl)oxy]- 3- ethoxyphenyl}- 3- (4- methylphenyl)- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)Cl)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)C

STK548431
Synonyms: 6,6'- [(4- nitrophenyl)methanediyl]bis(7- hydroxy- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidin- 5- one)
Smiles: Oc1nc2SCCn2c(=O)c1[C@H](c1c(O)nc2n(c1=O)CCS2)c1ccc(cc1)[N+](=O)[O-]

STK548432
Synonyms: 2,2- dichloro- N- (4- chloropyridin- 2- yl)- 1- phenylcyclopropanecarboxamide
Smiles: Clc1ccnc(c1)NC(=O)C1(CC1(Cl)Cl)c1ccccc1

STK548433
Synonyms: 2- {[2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)- 2- oxoethyl]sulfanyl}- 6- methyl- 4- (thiophen- 3- yl)- 5,6,7,8- tetrahydro- 1,6- naphthyridine- 3- carbonitrile
Smiles: N#Cc1c(SCC(=O)N2CCc3c(C2)cc(c(c3)OC)OC)nc2c(c1c1cscc1)CN(CC2)C

STK548434
Synonyms: N- [1- (1- benzyl- 1H- benzimidazol- 2- yl)- 3- (methylsulfanyl)propyl]- 4- tert- butylbenzamide
Smiles: CSCCC(c1nc2c(n1Cc1ccccc1)cccc2)NC(=O)c1ccc(cc1)C(C)(C)C

STK548435
Synonyms: (3aR,4S,9aR,9bS)- 4- [(4- chlorophenyl)carbonyl]- 2- (4- methylphenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccc(cc2)Cl)C=CC(=C1)C(=O)c1ccccc1

STK548437
Synonyms: N'- [(E)- (2- hydroxyphenyl)methylidene]- 2- (5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])N/N=C/c1ccccc1O

STK548438
Synonyms: ethyl4- [3- hydroxy- 5- (2- nitrophenyl)- 2- oxo- 4- (phenylcarbonyl)- 2,5- dihydro- 1H- pyrrol- 1- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1[N+](=O)[O-])C(=O)c1ccccc1)O

STK548439
Synonyms: 2- amino- 1- (3,5- dimethylphenyl)- N- (2- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccccc1NC(=O)c1c2nc3ccccc3nc2n(c1N)c1cc(C)cc(c1)C

STK548440
Synonyms: (5E)- 1- benzyl- 5- ({[3- (1H- imidazol- 1- yl)propyl]amino}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/NCCCn1ccnc1)Cc1ccccc1

STK548441
Synonyms: N- [1- (1H- benzimidazol- 2- yl)butyl]furan- 2- carboxamide
Smiles: CCCC(c1nc2c([nH]1)cccc2)NC(=O)c1ccco1

STK548442
Synonyms: phenyl(4- methyl- 2- {[(4- methylphenyl)sulfonyl]amino}- 1,3- thiazol- 5- yl)carbamate
Smiles: O=C(Nc1sc(nc1C)NS(=O)(=O)c1ccc(cc1)C)Oc1ccccc1

STK548444
Synonyms: 5- ethyl- 3,10,10- trimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCc1nc2sc3c(c2c2n1c(C)nn2)CC(OC3)(C)C

STK548445
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (2- fluorophenyl)- 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)c1ccccc1F)cccc3

STK548447
Synonyms: 4- [4- (4- methylbenzyl)piperazin- 1- yl]- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine
Smiles: Cc1ccc(cc1)CN1CCN(CC1)c1ncnc2c1c1CCCCc1s2

STK548449
Synonyms: 3- [3- (2- iodophenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccccc1I

STK548450
Synonyms: 4- [(1E)- 1- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (morpholin- 4- ylmethyl)- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)ethyl]- 2- methoxyphenyl4- chlorobenzoate
Smiles: COc1cc(ccc1OC(=O)c1ccc(cc1)Cl)/C(=N/NC(=O)c1nnn(c1CN1CCOCC1)c1nonc1N)/C

STK548451
Synonyms: 4- amino- N'- {(E)- [3- bromo- 5- ethoxy- 4- (naphthalen- 1- ylmethoxy)phenyl]methylidene}- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: CCOc1cc(/C=N/N=C(/c2nonc2N)\N)cc(c1OCc1cccc2c1cccc2)Br

STK548452
Synonyms: (5Z)- 3- (3- chloro- 4- methylbenzyl)- 5- (2,3- dimethoxybenzylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1cccc(c1OC)/C=C/1\SC(=S)N(C1=O)Cc1ccc(c(c1)Cl)C

STK548453
Synonyms: 1- [1- (1H- benzimidazol- 2- yl)- 3- (methylsulfanyl)propyl]- 3- phenylurea
Smiles: CSCCC(c1nc2c([nH]1)cccc2)NC(=O)Nc1ccccc1

STK548454
Synonyms: 2,4- dichloro- N- (2- {(2Z)- 2- [1- (3- cyanopropyl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]hydrazinyl}- 2- oxoethyl)benzamide(non- preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)c2ccc(cc2Cl)Cl)/c2c1cccc2

STK548455
Synonyms: 3- [3- (4- chloro- 3,5- dimethylphenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cc(C)c(c(c1)C)Cl

STK548456
Synonyms: (4R,4aR)- 2- amino- 4- (2,5- dimethoxyphenyl)- 6- methyl- 4a,5,6,7- tetrahydronaphthalene- 1,3,3(4H)- tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCC(C2)C)c1cc(OC)ccc1OC)(C#N)C#N

STK548457
Synonyms: 2- (4- methoxyphenyl)- 3- [3- (naphthalen- 1- yloxy)propyl]quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cccc2c1cccc2

STK548458
Synonyms: 3- butyl- 2- [(2- phenylethyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCn1c(SCCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548460
Synonyms: pentyl4- [(6- bromoquinazolin- 4- yl)amino]benzoate
Smiles: CCCCCOC(=O)c1ccc(cc1)Nc1ncnc2c1cc(Br)cc2

STK548461
Synonyms: 2- [(3- benzyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N,N- diethylacetamide
Smiles: CCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3)CC

STK548462
Synonyms: diethyl5- ({(2E)- 2- cyano- 3- [4- (propan- 2- yl)phenyl]prop- 2- enoyl}amino)- 3- methylthiophene- 2,4- dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C(=C/c2ccc(cc2)C(C)C)/C#N)sc(c1C)C(=O)OCC

STK548464
Synonyms: 2,6- dimethoxy- N- [(2- methoxydibenzo[b,d]furan- 3- yl)carbamothioyl]benzamide
Smiles: COc1cc2c(cc1NC(=S)NC(=O)c1c(OC)cccc1OC)oc1c2cccc1

STK548465
Synonyms: 3- [2- (2,4- dimethylphenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(cc1C)C

STK548466
Synonyms: methyl4- {6- [(3- chlorophenyl)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(Nc1cccc(c1)Cl)nc1c2cccc1

STK548467
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- [(4- fluorobenzyl)oxy]phenyl}methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Fc1ccc(cc1)COc1cccc(c1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK548468
Synonyms: 4- amino- N'- [(E)- {3- [(2- chlorobenzyl)oxy]phenyl}methylidene]- 1,2,5- oxadiazole- 3- carbohydrazonamide
Smiles: Clc1ccccc1COc1cccc(c1)/C=N/N=C(/c1nonc1N)\N

STK548469
Synonyms: ethyl2- [(3- {[(4- fluorophenyl)sulfonyl]amino}quinoxalin- 2- yl)amino]- 4,5- dimethylthiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccc(cc2)F)sc(c1C)C

STK548470
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 5- methoxy- 4- [(2- methylbenzyl)oxy]phenyl}methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)cc(c1OCc1ccccc1C)Br

STK548472
Synonyms: 5- (4- tert- butylphenyl)- 1- (3- chlorophenyl)- 3- [(3- chlorophenyl)amino]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Clc1cccc(c1)N1C(=O)C(=CC1c1ccc(cc1)C(C)(C)C)Nc1cccc(c1)Cl

STK548473
Synonyms: 3- amino- N- (2,6- dimethylphenyl)- 4- (4- methoxyphenyl)- 6- (thiophen- 2- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1ccc(cc1)c1cc(nc2c1c(N)c(s2)C(=O)Nc1c(C)cccc1C)c1cccs1

STK548474
Synonyms: N- (4- phenylbutan- 2- yl)- 2- [(5- phenyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetamide
Smiles: CC(NC(=O)CSc1nnc2n1c(nc1c2c2CCCCc2s1)c1ccccc1)CCc1ccccc1

STK548475
Synonyms: 2- (4- methoxyphenyl)- 3- {3- [2- methoxy- 4- (prop- 2- en- 1- yl)phenoxy]propyl}quinazolin- 4(3H)- one
Smiles: C=CCc1ccc(c(c1)OC)OCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STK548476
Synonyms: 2- (4- chlorophenyl)- 3- [5- (2- methoxy- 4- methylphenoxy)pentyl]quinazolin- 4(3H)- one
Smiles: COc1cc(C)ccc1OCCCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)Cl

STK548477
Synonyms: methyl5- (4- nitrophenyl)- 4,6- dioxo- 1,3a,4,5,6,6a- hexahydropyrrolo[3,4- c]pyrazole- 3- carboxylate
Smiles: COC(=O)C1=NNC2C1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-]

STK548478
Synonyms: propan- 2- yl2- amino- 1- (2- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CC(OC(=O)c1c2nc3ccccc3nc2n(c1N)CCc1ccccc1)C

STK548479
Synonyms: N- {1- (3- butoxypropyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}benzenesulfonamide
Smiles: CCCCOCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccccc1)S(=O)(=O)c1ccc(cc1)C

STK548480
Synonyms: 5- {[(1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)amino]methylidene}- 1,3- bis(2- methoxyphenyl)- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: COc1ccccc1N1C(=O)/C(=C/Nc2c(C)n(n(c2=O)c2ccccc2)C)/C(=O)N(C1=S)c1ccccc1OC

STK548481
Synonyms: 2- [(6,6- dimethyl- 2- phenyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]- N- (2- methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nc(nc2c1c1CC(C)(C)OCc1s2)c1ccccc1

STK548482
Synonyms: [(4- bromophenyl)sulfonyl]{1,4- dioxo- 3- [1- (propan- 2- yl)- 1H- imidazol- 3- ium- 3- yl]- 1,4- dihydronaphthalen- 2- yl}azanide
Smiles: Brc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2ccn(c2)C(C)C)C(=O)c2c(C1=O)cccc2

STK548483
Synonyms: 1- benzyl- 4- [(4- chlorophenyl)carbonyl]- 3- hydroxy- 5- (4- nitrophenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])Cc1ccccc1

STK548484
Synonyms: N- [1- (1H- benzimidazol- 2- yl)- 3- (methylsulfanyl)propyl]- 4- bromobenzamide
Smiles: CSCCC(c1nc2c([nH]1)cccc2)NC(=O)c1ccc(cc1)Br

STK548485
Synonyms: 1- (9H- carbazol- 9- yl)- 3- [4- (4- chlorobenzyl)piperazin- 1- yl]propan- 2- ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)CN1CCN(CC1)Cc1ccc(cc1)Cl

STK548486
Synonyms: ethyl4- [3- (4- ethoxy- 3- nitrophenyl)- 1- phenyl- 1H- pyrazol- 4- yl]- 6- methyl- 2- oxo- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=O)NC1c1cn(nc1c1ccc(c(c1)[N+](=O)[O-])OCC)c1ccccc1

STK548487
Synonyms: 1- [4- (4- ethylphenyl)- 3'- (4- nitrophenyl)- 2- phenyl- 2H,3'H- spiro[phthalazine- 1,2'- [1,3,4]thiadiazol]- 5'- yl]ethanone
Smiles: CCc1ccc(cc1)C1=NN(c2ccccc2)C2(c3c1cccc3)SC(=NN2c1ccc(cc1)[N+](=O)[O-])C(=O)C

STK548488
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- (4- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCC(OC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)OC)C

STK548489
Synonyms: N- {3- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl}benzenesulfonamide
Smiles: O=C1C(=C(N2CCN(CC2)Cc2ccc3c(c2)OCO3)C(=O)c2c1cccc2)NS(=O)(=O)c1ccccc1

STK548491
Synonyms: 2- {[3- cyano- 6- (4- methoxyphenyl)- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (3,4,5- trimethoxyphenyl)acetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)Nc2cc(OC)c(c(c2)OC)OC)c(c(c1)c1cccs1)C#N

STK548492
Synonyms: 3,4- dimethoxy- N- (morpholin- 4- ylcarbonothioyl)benzamide
Smiles: COc1cc(ccc1OC)C(=O)NC(=S)N1CCOCC1

STK548495
Synonyms: 11- (3- chloro- 4- methoxyphenyl)- 3- hexyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)Cl)OC

STK548496
Synonyms: 4- [(4- chlorophenyl)carbonyl]- 1- (4- fluorophenyl)- 3- hydroxy- 5- (2- methoxyphenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccccc1C1C(=C(C(=O)N1c1ccc(cc1)F)O)C(=O)c1ccc(cc1)Cl

STK548497
Synonyms: N- (2,4- dimethoxyphenyl)- 11- (4- fluorophenyl)- 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(C2c2ccc(cc2)F)c(nn1c1ccccc1)C

STK548498
Synonyms: N,N,4- tributyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- amine
Smiles: CCCCN(c1ncnc2c1sc1c2c2CCCc2c(n1)CCCC)CCCC

STK548499
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(2- chlorobenzyl)oxy]phenyl}methylidene]- 5- (morpholin- 4- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCOCC1)c1nonc1N)N/N=C/c1ccc(cc1)OCc1ccccc1Cl

STK548500
Synonyms: methyl3- [(2- bromohexanoyl)amino]- 5- chloro- 1H- indole- 2- carboxylate
Smiles: CCCCC(C(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC)Br

STK548502
Synonyms: N- {[2- (1,3- benzodioxol- 5- ylcarbonyl)hydrazinyl]carbonothioyl}pyridine- 3- carboxamide
Smiles: S=C(NC(=O)c1cccnc1)NNC(=O)c1ccc2c(c1)OCO2

STK548503
Synonyms: N'- [(E)- (2,6- dichlorophenyl)methylidene]- 4- [(5- methyl- 3- nitro- 1H- pyrazol- 1- yl)methyl]benzohydrazide
Smiles: O=C(c1ccc(cc1)Cn1nc(cc1C)[N+](=O)[O-])N/N=C/c1c(Cl)cccc1Cl

STK548504
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- cyclohex- 3- en- 1- ylmethylidene]- 5- (morpholin- 4- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCOCC1)c1nonc1N)N/N=C/C1CCC=CC1

STK548505
Synonyms: (1Z)- N'- {[(4- bromo- 3- methylphenoxy)acetyl]oxy}- 2- (4- chlorophenyl)ethanimidamide
Smiles: O=C(O/N=C(/Cc1ccc(cc1)Cl)\N)COc1ccc(c(c1)C)Br

STK548509
Synonyms: 7- methyl- 2- {[4- (propan- 2- yloxy)benzyl]sulfanyl}- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- amine
Smiles: CC1CCc2c(C1)sc1c2c(N)nc(n1)SCc1ccc(cc1)OC(C)C

STK548510
Synonyms: 5- (3- nitrophenyl)- 2,3,3a- triphenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: O=C1N(c2cccc(c2)[N+](=O)[O-])C(=O)C2(C1ON(C2c1ccccc1)c1ccccc1)c1ccccc1

STK548511
Synonyms: 2- amino- 1- (4- chlorophenyl)- N- hexyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)Cl

STK548513
Synonyms: N'~1~,N'~8~- bis[(3Z)- 5- methoxy- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]octanedihydrazide
Smiles: COc1ccc2c(c1)/C(=N/NC(=O)CCCCCCC(=O)N/N=C/1\C(=O)Nc3c1cc(OC)cc3)/C(=O)N2

STK548514
Synonyms: (5E)- 5- (4- butoxybenzylidene)- 2- [4- (2- nitrophenyl)piperazin- 1- yl]- 1,3- thiazol- 4(5H)- one
Smiles: CCCCOc1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccccc1[N+](=O)[O-]

STK548515
Synonyms: (2E)- N- ({4- [(5- ethyl- 1,3,4- thiadiazol- 2- yl)sulfamoyl]phenyl}carbamothioyl)- 3- phenylprop- 2- enamide
Smiles: CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)/C=C/c1ccccc1

STK548517
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- ethoxy- 4- [(2- methylbenzyl)oxy]phenyl}methylidene]- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)ccc1OCc1ccccc1C

STK548518
Synonyms: [(5- bromothiophen- 2- yl)sulfonyl]{3- [4- (3- phenylpropyl)pyridinium- 1- yl]quinoxalin- 2- yl}azanide
Smiles: Brc1ccc(s1)S(=O)(=O)[N-]c1nc2ccccc2nc1[n+]1ccc(cc1)CCCc1ccccc1

STK548519
Synonyms: 3- hexyl- 11- [2- (4- methoxyphenyl)ethyl]- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2CCc1ccc(cc1)OC

STK548521
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- ethoxy- 4- [(3- fluorobenzyl)oxy]phenyl}methylidene]- 5- methyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)ccc1OCc1cccc(c1)F

STK548522
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [4- (benzyloxy)- 3- methoxyphenyl]methylidene}- 5- [(diethylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(c(c1)OC)OCc1ccccc1)CC

STK548523
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(1Z)- 1- (2- chlorophenyl)ethylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Clc1ccccc1/C(=N\NC(=O)c1nnn(c1c1ccccc1)c1nonc1N)/C

STK548524
Synonyms: 4- [(4- chlorophenyl)carbonyl]- 3- hydroxy- 5- (3- nitrophenyl)- 1- phenyl- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Clc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1ccccc1

STK548525
Synonyms: 11- (3- chloro- 4- methoxyphenyl)- 3- (2- methoxyethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)Cl)OC

STK548526
Synonyms: 3- benzyl- 11- (3- chlorophenyl)- 2- methyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Clc1cccc(c1)n1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)Cc1ccccc1

STK548527
Synonyms: 3- (2,5- dibromophenyl)- 2- [(E)- 2- (2- nitrophenyl)ethenyl]quinazolin- 4(3H)- one
Smiles: Brc1ccc(c(c1)n1c(/C=C/c2ccccc2[N+](=O)[O-])nc2c(c1=O)cccc2)Br

STK548528
Synonyms: N- [4- (4,4- dimethyl- 3,5- diphenyl- 4,5- dihydro- 1H- pyrazol- 1- yl)benzyl]- 4- methylaniline
Smiles: Cc1ccc(cc1)NCc1ccc(cc1)N1N=C(C(C1c1ccccc1)(C)C)c1ccccc1

STK548529
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- [(4- chloro- 3,5- dimethylphenoxy)methyl]- 4- methoxyphenyl}methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1ccc(cc1COc1cc(C)c(c(c1)C)Cl)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK548530
Synonyms: prop- 2- en- 1- yl2- amino- 1- (4- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)OC

STK548531
Synonyms: N'- (6- chloro- 4- phenylquinazolin- 2- yl)furan- 2- carbohydrazide
Smiles: Clc1ccc2c(c1)c(nc(n2)NNC(=O)c1ccco1)c1ccccc1

STK548532
Synonyms: 2- amino- N- (2,5- dimethylphenyl)- 1- (3- methylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Cc1ccc(c(c1)NC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)C)C

STK548533
Synonyms: N- [3- (4- benzylpiperidin- 1- yl)- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl]- 4- bromobenzenesulfonamide
Smiles: Brc1ccc(cc1)S(=O)(=O)NC1=C(N2CCC(CC2)Cc2ccccc2)C(=O)c2c(C1=O)cccc2

STK548534
Synonyms: 3- {[butyl(methyl)amino]methyl}- 2,6,8- trimethylquinolin- 4- ol
Smiles: CCCCN(Cc1c(C)nc2c(c1O)cc(cc2C)C)C

STK548535
Synonyms: 3- {4- (4- ethoxyphenyl)- 5- [(2- fluorobenzyl)sulfanyl]- 4H- 1,2,4- triazol- 3- yl}pyridine
Smiles: CCOc1ccc(cc1)n1c(SCc2ccccc2F)nnc1c1cccnc1

STK548537
Synonyms: N,4- dimethyl- N- {4- oxo- 4- [4- (pyridin- 2- yl)piperazin- 1- yl]butyl}benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N(CCCC(=O)N1CCN(CC1)c1ccccn1)C

STK548538
Synonyms: 3- butyl- 11- (3- chloro- 4- methoxyphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)Cl)OC

STK548539
Synonyms: N- (2,4- dimethylphenyl)- 2- {[3- (2- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3

STK548540
Synonyms: 3- hydroxy- 4- (phenylcarbonyl)- 5- [4- (propan- 2- yl)phenyl]- 1- (prop- 2- en- 1- yl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: C=CCN1C(c2ccc(cc2)C(C)C)C(=C(C1=O)O)C(=O)c1ccccc1

STK548541
Synonyms: [(4- methylphenyl)sulfonyl][3- (4- methylpiperazin- 1- yl)quinoxalin- 2- yl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)C)c1nc2ccccc2nc1N1CCN(CC1)C

STK548542
Synonyms: 3- chloro- 4- [(4- methoxyphenyl)amino]- 1- (naphthalen- 1- yl)- 1H- pyrrole- 2,5- dione
Smiles: COc1ccc(cc1)NC1=C(Cl)C(=O)N(C1=O)c1cccc2c1cccc2

STK548544
Synonyms: 2- chloro- N- (2- {(2Z)- 2- [1- (3- cyanopropyl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]hydrazinyl}- 2- oxoethyl)benzamide(non- preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)c2ccccc2Cl)/c2c1cccc2

STK548545
Synonyms: 2- {[1- (4- chlorobenzyl)- 1H- benzimidazol- 2- yl]sulfanyl}- N'- [(E)- 1H- indol- 3- ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nc2c(n1Cc1ccc(cc1)Cl)cccc2)N/N=C/c1c[nH]c2c1cccc2

STK548546
Synonyms: N,N- diethyl- 2- {[4- oxo- 3- (prop- 2- en- 1- yl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)N(CC)CC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548547
Synonyms: 2- methoxyethyl2- amino- 1- (4- butylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)OCCOC

STK548548
Synonyms: (3aR,4S,9aR,9bS)- 2- (4- chlorophenyl)- 4- [(4- chlorophenyl)carbonyl]- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)Cl)C(=O)c1ccccc1

STK548549
Synonyms: (3aR,4S,9aR,9bS)- 4- [(4- chlorophenyl)carbonyl]- 2- (4- fluorophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccc(cc2)Cl)C=CC(=C1)C(=O)c1ccccc1

STK548550
Synonyms: methyl2- amino- 1- (2,4- dimethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1OC)OC

STK548551
Synonyms: 3- {[(E)- (2- hydroxy- 6- nitronaphthalen- 1- yl)methylidene]amino}- 2- propylquinazolin- 4(3H)- one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1c(O)ccc2c1ccc(c2)[N+](=O)[O-]

STK548552
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [3- methoxy- 4- (naphthalen- 1- ylmethoxy)phenyl]methylidene}- 5- [(4- methylpiperazin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCN(CC2)C)c2nonc2N)ccc1OCc1cccc2c1cccc2

STK548554
Synonyms: 4- [(5Z)- 5- (1H- indol- 3- ylmethylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]benzoicacid
Smiles: S=C1S/C(=C\c2c[nH]c3c2cccc3)/C(=O)N1c1ccc(cc1)C(=O)O

STK548555
Synonyms: N- ethyl- 2- imino- 10- methyl- 1- (4- methylbenzyl)- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: CCNC(=O)c1cc2c(n(c1=N)Cc1ccc(cc1)C)nc1n(c2=O)cccc1C

STK548556
Synonyms: 4- {2- [(2E)- 2- (2- hydroxybenzylidene)hydrazinyl]- 2- oxoethoxy}- N'- [(E)- (2- hydroxyphenyl)methylidene]benzohydrazide
Smiles: O=C(COc1ccc(cc1)C(=O)N/N=C/c1ccccc1O)N/N=C/c1ccccc1O

STK548557
Synonyms: [3- (3- {[(4- chlorophenyl)carbonyl]amino}pyridinium- 1- yl)quinoxalin- 2- yl](phenylsulfonyl)azanide
Smiles: Clc1ccc(cc1)C(=O)Nc1ccc[n+](c1)c1nc2ccccc2nc1[N-]S(=O)(=O)c1ccccc1

STK548558
Synonyms: 3- (hexylsulfanyl)- 5- phenyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCCCCCSc1nnc2n1c(nc1c2c2CCCc2s1)c1ccccc1

STK548560
Synonyms: 3- [3- (2,6- dimethoxyphenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(OC)cccc1OC

STK548561
Synonyms: 9- [(3- methylbutyl)sulfanyl]- 8- (2- methylprop- 2- en- 1- yl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CC(=C)Cn1c(SCCC(C)C)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK548562
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- phenyl- N'- [(E)- (2,3,4- trimethoxyphenyl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1c(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)ccc(c1OC)OC

STK548563
Synonyms: N- [1- (4- chlorophenyl)- 2,5- dioxopyrrolidin- 3- yl]- 3- fluoro- N- [2- (4- methoxyphenyl)ethyl]benzamide
Smiles: COc1ccc(cc1)CCN(C(=O)c1cccc(c1)F)C1CC(=O)N(C1=O)c1ccc(cc1)Cl

STK548565
Synonyms: (2E)- 3- (4- bromophenyl)- N- ({4- [(4,6- dimethylpyrimidin- 2- yl)sulfamoyl]phenyl}carbamothioyl)prop- 2- enamide
Smiles: S=C(Nc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(n1)C)NC(=O)/C=C/c1ccc(cc1)Br

STK548566
Synonyms: 2'- (biphenyl- 4- yl)- 2,2- dimethyl- 1',2,3,5,6,10b'- hexahydrospiro[pyran- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CC1(C)OCCC2(C1)Oc1ccccc1C1N2N=C(C1)c1ccc(cc1)c1ccccc1

STK548567
Synonyms: 2- {[6- amino- 4- (2- chlorophenyl)- 3,5- dicyanopyridin- 2- yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)N)nc(c(c1c1ccccc1Cl)C#N)N

STK548568
Synonyms: 2- [(4- oxo- 3- propyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N,N- diphenylacetamide
Smiles: CCCn1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548569
Synonyms: 2- [(E)- 2- (4- nitrophenyl)ethenyl]- 3- (pyridin- 4- yl)quinazolin- 4(3H)- one
Smiles: O=c1n(c2ccncc2)c(/C=C/c2ccc(cc2)[N+](=O)[O-])nc2c1cccc2

STK548570
Synonyms: (8S,8aR,11aS)- 8- [(4- methoxyphenyl)carbonyl]- 10- (4- nitrophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-])cccc3

STK548571
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)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: Clc1ccc(cc1)C(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2C2N1N=Cc1c2cccc1)c1ccc2c(c1)cccc2

STK548572
Synonyms: ethyl6- bromo- 4- [(5- hydroxypentyl)amino]quinoline- 3- carboxylate
Smiles: OCCCCCNc1c(cnc2c1cc(Br)cc2)C(=O)OCC

STK548573
Synonyms: N- ethyl- 1- (2- hydroxyethyl)- 2- imino- 10- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: OCCn1c(=N)c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCC

STK548575
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 4- [(2- fluorobenzyl)oxy]- 5- methoxyphenyl}methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)cc(c1OCc1ccccc1F)Br

STK548576
Synonyms: ethyl6- methyl- 2- ({[(3,4,5- trimethoxyphenyl)carbonyl]carbamothioyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2cc(OC)c(c(c2)OC)OC)sc2c1CCC(C2)C

STK548577
Synonyms: 3- amino- N- (2,5- dichlorophenyl)- 6- (thiophen- 2- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: Clc1ccc(c(c1)NC(=O)c1sc2c(c1N)ccc(n2)c1cccs1)Cl

STK548578
Synonyms: 3- [4- (decyloxy)phenyl]- 1- [(2,6- difluorobenzyl)oxy]quinoxalin- 2(1H)- one4- oxide
Smiles: CCCCCCCCCCOc1ccc(cc1)c1c(=O)n(OCc2c(F)cccc2F)c2c([n+]1[O-])cccc2

STK548580
Synonyms: 3- [(Z)- (3- cyclopentyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 2- (4- ethylpiperazin- 1- yl)- 9- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCCC1

STK548581
Synonyms: N,N- dibutyl- 2- {[3- (3- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)OC)CCCCC3)CCCC

STK548582
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 5- ethoxy- 4- [(4- fluorobenzyl)oxy]phenyl}methylidene]- 5- (phenoxymethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2COc2ccccc2)c2nonc2N)cc(c1OCc1ccc(cc1)F)Br

STK548583
Synonyms: 3- [2- (2,4- dichlorophenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(cc1Cl)Cl

STK548584
Synonyms: 11- (3- chlorophenyl)- 3- (3,5- dimethylphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Clc1cccc(c1)n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK548585
Synonyms: methylcyano[3- (3,5- dimethylpiperidin- 1- yl)quinoxalin- 2- yl]acetate
Smiles: N#CC(c1nc2ccccc2nc1N1CC(C)CC(C1)C)C(=O)OC

STK548586
Synonyms: methyl2- ({(2E)- 2- cyano- 3- [4- (propan- 2- yl)phenyl]prop- 2- enoyl}amino)- 4,5- dimethylthiophene- 3- carboxylate
Smiles: N#C/C(=C\c1ccc(cc1)C(C)C)/C(=O)Nc1sc(c(c1C(=O)OC)C)C

STK548588
Synonyms: ethyl4- {[11- (3- bromophenyl)- 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)Br)c(nn1c1ccccc1)C

STK548589
Synonyms: 3- (2- methoxyphenyl)- 2- [(3- methylbutyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: COc1ccccc1n1c(SCCC(C)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK548590
Synonyms: (8S,8aR,11aS)- 10- (4- butoxyphenyl)- 8- [(4- chlorophenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: CCCCOc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1C2c2ccccc2C=C1)C(=O)c1ccc(cc1)Cl

STK548591
Synonyms: 2- methoxyethyl2- amino- 1- (4- bromophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)Br

STK548592
Synonyms: 2- (prop- 2- en- 1- ylsulfanyl)- 3- propyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCn1c(SCC=C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548593
Synonyms: 3- [(E)- (2- {[1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- 1H- 1,2,3- triazol- 4- yl]carbonyl}hydrazinylidene)methyl]phenyl4- chloro- 3- nitrobenzoate
Smiles: O=C(c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)N/N=C/c1cccc(c1)OC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl

STK548594
Synonyms: 2- [(3- butyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N- (4- methoxyphenyl)acetamide
Smiles: CCCCn1c(SCC(=O)Nc2ccc(cc2)OC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548595
Synonyms: (4Z)- 2- (furan- 2- yl)- 4- (3- methoxy- 4- propoxybenzylidene)- 1,3- oxazol- 5(4H)- one
Smiles: CCCOc1ccc(cc1OC)/C=C/1\N=C(OC1=O)c1ccco1

STK548596
Synonyms: N- (3- chloro- 4- fluorophenyl)- 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)F)c1ccccc1

STK548598
Synonyms: N- (4- bromophenyl)- 2- [(5- ethyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetamide
Smiles: CCc1nc2sc3c(c2c2n1c(SCC(=O)Nc1ccc(cc1)Br)nn2)CCCC3

STK548599
Synonyms: 4- [(4- chlorophenyl)carbonyl]- 3- hydroxy- 5- phenyl- 1- (prop- 2- en- 1- yl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: C=CCN1C(c2ccccc2)C(=C(C1=O)O)C(=O)c1ccc(cc1)Cl

STK548600
Synonyms: 8- (4- methylphenyl)- 3,4a,7a,8- tetrahydropyrrolo[3',4':5,6]thiopyrano[2,3- d][1,3]thiazole- 2,5,7(6H)- trione
Smiles: O=C1NC(=O)C2C1C(c1ccc(cc1)C)c1c(S2)[nH]c(=O)s1

STK548601
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (4- ethylphenyl)methylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N

STK548602
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (3,5- dichlorophenyl)- 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)c1cc(Cl)cc(c1)Cl)cccc3

STK548603
Synonyms: 8- (2- methylprop- 2- en- 1- yl)- 9- [(2- phenylethyl)sulfanyl]- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CC(=C)Cn1c(SCCc2ccccc2)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK548604
Synonyms: N'- {[1,3- bis(2- methoxyphenyl)- 4,6- dioxo- 2- thioxotetrahydropyrimidin- 5(2H)- ylidene]methyl}- 2- hydroxybenzohydrazide
Smiles: COc1ccccc1N1C(=O)/C(=C/NNC(=O)c2ccccc2O)/C(=O)N(C1=S)c1ccccc1OC

STK548605
Synonyms: 1- [1- (3- chlorophenyl)- 8- (4- chlorophenyl)- 6- phenyl- 4- thia- 1,2,6,7- tetraazaspiro[4.5]deca- 2,7- dien- 3- yl]ethanone
Smiles: Clc1ccc(cc1)C1=NN(C2(CC1)SC(=NN2c1cccc(c1)Cl)C(=O)C)c1ccccc1

STK548606
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 4- [(4- fluorobenzyl)oxy]- 5- methoxyphenyl}methylidene]- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CNc2ccccc2)c2nonc2N)cc(c1OCc1ccc(cc1)F)Br

STK548607
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (3,4- dimethoxyphenyl)methylidene]- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CNc2ccccc2)c2nonc2N)ccc1OC

STK548608
Synonyms: 3- [2- (3,4- dimethylphenoxy)ethyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1ccc(c(c1)C)C

STK548609
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- methyl- N'- {(E)- [5- (4- nitrophenyl)furan- 2- yl]methylidene}- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1C)c1nonc1N)N/N=C/c1ccc(o1)c1ccc(cc1)[N+](=O)[O-]

STK548610
Synonyms: 3- tert- butyl- 7- {[2- (4- methylpiperidin- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: CC1CCN(CC1)CCNc1cc2oc3cc(ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1)C(C)(C)C

STK548612
Synonyms: 3- [3- (4- chlorophenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1ccc(cc1)Cl

STK548613
Synonyms: 6- amino- 3- (propan- 2- yl)- 4- [2- (trifluoromethyl)phenyl]- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1C(F)(F)F)c([nH]n2)C(C)C

STK548614
Synonyms: [3- (3,5- dimethylpyridinium- 1- yl)- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl](thiophen- 2- ylsulfonyl)azanide
Smiles: Cc1cc(C)c[n+](c1)C1=C([N-]S(=O)(=O)c2cccs2)C(=O)c2c(C1=O)cccc2

STK548615
Synonyms: (1'R,2'R)- 1'- [(4- chlorophenyl)carbonyl]- 2'- (3,4- dimethoxyphenyl)- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: COc1ccc(cc1OC)[C@H]1[C@H](C(=O)c2ccc(cc2)Cl)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1

STK548616
Synonyms: 2- {[6- iodo- 4- oxo- 3- (prop- 2- en- 1- yl)- 3,4- dihydroquinazolin- 2- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1=O)cc(cc2)I

STK548617
Synonyms: (8S,8aR,11aS)- 8- [(4- chlorophenyl)carbonyl]- 10- (2,4- dichlorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1Cl)Cl)cccc3

STK548618
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (4- tert- butylphenyl)methylidene]- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)N/N=C/c1ccc(cc1)C(C)(C)C

STK548620
Synonyms: 3- [3- (3,5- dimethylphenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cc(C)cc(c1)C

STK548621
Synonyms: 3- [3- (4- methoxyphenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)OCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STK548623
Synonyms: N- cyclohexyl- 1- (furan- 2- ylmethyl)- 2- {[(4- nitrophenyl)sulfonyl]amino}- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: [O-][N+](=O)c1ccc(cc1)S(=O)(=O)Nc1c(C(=O)NC2CCCCC2)c2c(n1Cc1ccco1)nc1c(n2)cccc1

STK548624
Synonyms: 2- imino- 1- methyl- 3- (phenylsulfonyl)- 1,2- dihydro- 5H- dipyrido[1,2- a:2',3'- d]pyrimidin- 5- one
Smiles: O=c1c2cc(c(=N)n(c2nc2n1cccc2)C)S(=O)(=O)c1ccccc1

STK548625
Synonyms: (4Z)- 2- phenyl- 4- [(1,3- thiazol- 2- ylamino)methylidene]- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C\Nc1nccs1)c1ccccc1

STK548626
Synonyms: 3- [3- (2- chloro- 4,6- dimethylphenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1c(C)cc(cc1Cl)C

STK548627
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(1E)- 1- (4- methoxyphenyl)ethylidene]- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1CN1CCC(CC1)C)c1nonc1N)/C

STK548628
Synonyms: N- (4- bromophenyl)- 2- ({5- [(4- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc(s1)SCc1ccc(cc1)Cl

STK548632
Synonyms: [(4- chlorophenyl)sulfonyl](3- {4- [(thiophen- 2- ylcarbonyl)amino]pyridinium- 1- yl}quinoxalin- 2- yl)azanide
Smiles: Clc1ccc(cc1)S(=O)(=O)[N-]c1nc2ccccc2nc1[n+]1ccc(cc1)NC(=O)c1cccs1

STK548633
Synonyms: 2- (4- methoxyphenyl)- 3- {3- [5- methyl- 2- (propan- 2- yl)phenoxy]propyl}quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cc(C)ccc1C(C)C

STK548634
Synonyms: 3- {4- (4- bromophenyl)- 5- [(4- methylbenzyl)sulfanyl]- 4H- 1,2,4- triazol- 3- yl}pyridine
Smiles: Cc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK548635
Synonyms: (8S,8aR,11aS)- 8- [(4- methoxyphenyl)carbonyl]- 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: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-])cccc3

STK548637
Synonyms: 2- (2- cyanoethyl)- 3- methyl- 1- (morpholin- 4- yl)pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: N#CCCc1c(C)c(C#N)c2n(c1N1CCOCC1)c1ccccc1n2

STK548638
Synonyms: 7- (4- bromophenyl)- N,N- diethyl- 7H- chromeno[2',3':4,5]pyrimido[1,6- a]benzimidazol- 3- amine
Smiles: CCN(c1ccc2c(c1)OC1=NC(n3c(C1=C2)nc1c3cccc1)c1ccc(cc1)Br)CC

STK548639
Synonyms: 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N,N- dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3)CCC

STK548641
Synonyms: 3- {4- (4- bromophenyl)- 5- [(4- fluorobenzyl)sulfanyl]- 4H- 1,2,4- triazol- 3- yl}pyridine
Smiles: Fc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK548642
Synonyms: (8S,8aR,11aS)- 10- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 8- [(4- methoxyphenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)OCCO2)cccc3

STK548643
Synonyms: (2E)- N- ({4- [(6- methoxypyrimidin- 4- yl)sulfamoyl]phenyl}carbamothioyl)- 3- (4- methylphenyl)prop- 2- enamide
Smiles: COc1ncnc(c1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)/C=C/c1ccc(cc1)C

STK548644
Synonyms: (8S,8aR,11aS)- 8- (phenylcarbonyl)- 10- [2- (trifluoromethyl)phenyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: O=C([C@H]1N2N=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1C(F)(F)F)cccc3)c1ccccc1

STK548646
Synonyms: 2- {[3- cyano- 4- (4- methoxyphenyl)- 6,7- dihydro- 5H- cyclopenta[b]pyridin- 2- yl]sulfanyl}- N- (3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)acetamide
Smiles: COc1ccc(cc1)c1c(C#N)c(SCC(=O)Nc2sc3c(c2C#N)CCCC3)nc2c1CCC2

STK548647
Synonyms: 2- [(4- amino- 7- methyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- (4- methylphenyl)acetamide
Smiles: CC1CCc2c(C1)sc1c2c(N)nc(n1)SCC(=O)Nc1ccc(cc1)C

STK548648
Synonyms: N- [2- (1H- benzimidazol- 2- yl)propan- 2- yl]- 2- methylbenzamide
Smiles: Cc1ccccc1C(=O)NC(c1nc2c([nH]1)cccc2)(C)C

STK548649
Synonyms: (9E)- 9- (2,4- dichlorobenzylidene)- 5- (2,4- dichlorophenyl)- 3- phenyl- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: Clc1ccc(c(c1)Cl)C1C2=C(N=c3n1c(cs3)c1ccccc1)/C(=C/c1ccc(cc1Cl)Cl)/CCC2

STK548651
Synonyms: (6aS,6bR,9aS,10R)- 10- [(3- bromo- 4- methoxyphenyl)carbonyl]- 8- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc3c(c1)OCCO3)C=Cc1c2cccc1

STK548652
Synonyms: {2- [3- {bis[2- (hydroxy- kappaO)ethyl]amino- kappaN}- 2- (hydroxy- kappaO)propoxy]- N- phenylbenzamidato(3- )}boron
Smiles: O=C(c1ccccc1OCC1C[N+]23[B-](O1)(OCC3)OCC2)Nc1ccccc1

STK548653
Synonyms: 3- hydroxy- 1- [(4- methylpiperidin- 1- yl)methyl]- 3- (2- oxo- 2- phenylethyl)- 1,3- dihydro- 2H- indol- 2- one
Smiles: CC1CCN(CC1)CN1c2ccccc2C(C1=O)(O)CC(=O)c1ccccc1

STK548654
Synonyms: (3aR,4S,9aR,9bS)- 4- [(3- bromo- 4- methoxyphenyl)carbonyl]- 2- (4- nitrophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-])C(=O)c1ccccc1

STK548657
Synonyms: methyl{3- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]quinoxalin- 2- yl}(cyano)acetate
Smiles: COC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2)C#N

STK548658
Synonyms: ethyl3- {4- cyano- 1- [(4- ethoxyphenyl)amino]- 3- methylpyrido[1,2- a]benzimidazol- 2- yl}propanoate
Smiles: CCOC(=O)CCc1c(C)c(C#N)c2n(c1Nc1ccc(cc1)OCC)c1ccccc1n2

STK548659
Synonyms: 3- {2- [4- (butan- 2- yl)phenoxy]ethyl}- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: CCC(c1ccc(cc1)OCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC)C

STK548660
Synonyms: N- [1,1,1,3,3,3- hexafluoro- 2- (2- phenylhydrazinyl)propan- 2- yl]- 2- phenoxyacetamide
Smiles: O=C(NC(C(F)(F)F)(C(F)(F)F)NNc1ccccc1)COc1ccccc1

STK548662
Synonyms: 1- {(E)- [(2- methoxyphenyl)imino]methyl}- 17- (2- nitrophenyl)- 17- azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca- 2,4,6,9,11,13- hexaene- 16,18- dione(non- preferredname)
Smiles: COc1ccccc1/N=C/C12C3C(C(=O)N(C3=O)c3ccccc3[N+](=O)[O-])C(c3c1cccc3)c1c2cccc1

STK548663
Synonyms: N- (3- chlorophenyl)- 4- [4- (prop- 2- yn- 1- yloxy)phenyl]phthalazin- 1- amine
Smiles: C#CCOc1ccc(cc1)c1nnc(c2c1cccc2)Nc1cccc(c1)Cl

STK548665
Synonyms: (4Z)- 2- (furan- 2- yl)- 4- ({5- [3- (trifluoromethyl)phenyl]furan- 2- yl}methylidene)- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C\c1ccc(o1)c1cccc(c1)C(F)(F)F)c1ccco1

STK548666
Synonyms: 2- {[4- (4- ethoxyphenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (4- fluorophenyl)ethanone
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)F)nnc1c1cccnc1

STK548668
Synonyms: 2- methoxyethyl1- (3- acetylphenyl)- 2- amino- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)C(=O)C

STK548670
Synonyms: (8S,8aR,11aS)- 10- (1,3- benzodioxol- 5- yl)- 8- [(3- nitrophenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: O=C([C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)OCO2)cccc3)c1cccc(c1)[N+](=O)[O-]

STK548671
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {2- [(2- chloro- 6- fluorobenzyl)oxy]- 4- (diethylamino)phenyl}methylidene]- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCN(c1ccc(c(c1)OCc1c(F)cccc1Cl)/C=N/NC(=O)c1nnn(c1CN1CCC(CC1)C)c1nonc1N)CC

STK548672
Synonyms: N- benzyl- 2- {[3- cyano- 6- (4- methoxyphenyl)- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)NCc2ccccc2)c(c(c1)c1cccs1)C#N

STK548673
Synonyms: [3- (4- {[(4- chlorophenyl)carbonyl]amino}pyridinium- 1- yl)quinoxalin- 2- yl][(4- ethoxyphenyl)sulfonyl]azanide
Smiles: CCOc1ccc(cc1)S(=O)(=O)[N-]c1nc2ccccc2nc1[n+]1ccc(cc1)NC(=O)c1ccc(cc1)Cl

STK548674
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 10- methyl- 8- phenyl- 11- [4- (propan- 2- yl)phenyl]- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(cc1Cl)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(C)C)c(nn1c1ccccc1)C

STK548675
Synonyms: N'- [(E)- (5- chloro- 2- hydroxyphenyl)methylidene]- 4- [(2,8- dimethylquinolin- 4- yl)amino]benzohydrazide
Smiles: Clc1ccc(c(c1)/C=N/NC(=O)c1ccc(cc1)Nc1cc(C)nc2c1cccc2C)O

STK548676
Synonyms: (3aR,4S,9aR,9bS)- 4- [(3- bromo- 4- methoxyphenyl)carbonyl]- 2- (2- methyl- 4- nitrophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-])C(=O)c1ccccc1

STK548677
Synonyms: 3- (4- tert- butylphenyl)- 11- (4- fluorophenyl)- 10- propanoyl- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: CCC(=O)N1c2ccccc2NC2=C(C1c1ccc(cc1)F)C(=O)CC(C2)c1ccc(cc1)C(C)(C)C

STK548678
Synonyms: 3- butyl- 11- (3,5- dichlorophenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1cc(Cl)cc(c1)Cl

STK548679
Synonyms: (8S,8aR,11aS)- 10- (2- chlorophenyl)- 8- [(4- chlorophenyl)carbonyl]- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1Cl)cccc3

STK548680
Synonyms: 2- amino- 1- (3- methylphenyl)- N- (1- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Cc1cccc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NC(c1ccccc1)C

STK548681
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [4- (2,4- dinitrophenoxy)- 3- ethoxyphenyl]methylidene}- 5- methyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

STK548682
Synonyms: 2,4- dichlorobenzylN'- cyano- N- propan- 2- ylcarbamimidothioate
Smiles: N#C/N=C(/NC(C)C)\SCc1ccc(cc1Cl)Cl

STK548683
Synonyms: 2- {[6- tert- butyl- 3- cyano- 4- (trifluoromethyl)pyridin- 2- yl]sulfanyl}- N- (1,3- thiazol- 2- yl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2nccs2)nc(cc1C(F)(F)F)C(C)(C)C

STK548684
Synonyms: 3- [3- (2- methoxy- 4- methylphenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1cc(C)ccc1OCCCn1c(nc2c(c1=O)cccc2)c1ccc(cc1)OC

STK548685
Synonyms: 1- benzyl- 2- imino- 10- methyl- 5- oxo- N- (2- phenylethyl)- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: Cc1cccn2c1nc1n(Cc3ccccc3)c(=N)c(cc1c2=O)C(=O)NCCc1ccccc1

STK548687
Synonyms: 2- {[(2Z)- 3- chlorobut- 2- en- 1- yl]sulfanyl}- 6- iodo- 3- (4- methylphenyl)quinazolin- 4(3H)- one
Smiles: C/C(=C/CSc1nc2ccc(cc2c(=O)n1c1ccc(cc1)C)I)/Cl

STK548690
Synonyms: N- {2- [3- hydroxy- 5- (3- nitrophenyl)- 2- oxo- 4- (phenylcarbonyl)- 2,5- dihydro- 1H- pyrrol- 1- yl]ethyl}acetamide
Smiles: CC(=O)NCCN1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)c1ccccc1

STK548692
Synonyms: 2,8,8- trimethyl- 4- (pentyloxy)- 7,10- dihydro- 8H- pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CCCCCOc1nc(C)nc2c1sc1c2cc2c(n1)CC(OC2)(C)C

STK548695
Synonyms: N- (3,4- difluorophenyl)- 6- methyl- 4- [4- (propan- 2- yl)phenyl]- 2- thioxo- 1,2,3,4- tetrahydropyrimidine- 5- carboxamide
Smiles: S=C1NC(=C(C(N1)c1ccc(cc1)C(C)C)C(=O)Nc1ccc(c(c1)F)F)C

STK548696
Synonyms: methyl5- chloro- 3- {[(3,4,5- trimethoxyphenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1cc(OC)c(c(c1)OC)OC)cc(cc2)Cl

STK548698
Synonyms: (8S,8aR,11aS)- N- (4- chlorophenyl)- 9,11- dioxo- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 8- carboxamide
Smiles: O=C([C@@H]1[C@@H]2C(=O)NC(=O)[C@@H]2C2N1C=Cc1c2cccc1)Nc1ccc(cc1)Cl

STK548699
Synonyms: 2- methyl- 7- [(2- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}ethyl)amino]- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: Cc1ccc2c(c1)[nH]c1c(o2)cc(c2c1c(=O)c1c(c2=O)cccc1)NCCN1CCN(CC1)c1cccc(c1)C(F)(F)F

STK548700
Synonyms: 2- amino- 1- (4- ethoxyphenyl)- N- (3- methylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCOc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)Nc1cccc(c1)C

STK548702
Synonyms: 1- (1- benzyl- 5- methoxy- 2- methyl- 1H- indol- 3- yl)- 2- (4- methylpiperazin- 1- yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)C)c(n2Cc1ccccc1)C

STK548703
Synonyms: propan- 2- yl2- amino- 1- [2- (3,4- dimethoxyphenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COc1cc(ccc1OC)CCn1c2nc3ccccc3nc2c(c1N)C(=O)OC(C)C

STK548704
Synonyms: dimethyl(trichloroacetyl)phosphoramidate
Smiles: COP(=O)(NC(=O)C(Cl)(Cl)Cl)OC

STK548705
Synonyms: 2- [(3- butyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N- (2- phenylethyl)acetamide
Smiles: CCCCn1c(SCC(=O)NCCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548707
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (2,3- dihydro- 1H- indol- 1- ylmethyl)- N'- [(E)- {4- [(4- fluorobenzyl)oxy]phenyl}methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Fc1ccc(cc1)COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N

STK548709
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 2- ({5- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1Cl)NC(=O)CSc1nnc(s1)SCc1cccc2c1cccc2

STK548711
Synonyms: N- [4- (acetylamino)phenyl]- 2- {[4- (4- chlorophenyl)- 5- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(cc1)NC(=O)C

STK548714
Synonyms: 2- {[3- (4- methylphenyl)- 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)n1c1ccc(cc1)C)CCCCC3)CCC

STK548716
Synonyms: 2- methyl- 7- {[2- (4- methylpiperazin- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: CN1CCN(CC1)CCNc1cc2oc3ccc(cc3[nH]c2c2c1c(=O)c1ccccc1c2=O)C

STK548717
Synonyms: 2- ({5- [3- (1,3- dioxo- 1H- benzo[de]isoquinolin- 2(3H)- yl)propyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (pyridin- 3- ylmethyl)acetamide
Smiles: C=CCn1c(CCCn2c(=O)c3cccc4c3c(c2=O)ccc4)nnc1SCC(=O)NCc1cccnc1

STK548718
Synonyms: N'- [(E)- (2,3- dichlorophenyl)methylidene]- 2- (5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])N/N=C/c1cccc(c1Cl)Cl

STK548719
Synonyms: ethyl3- [(diethylamino)methyl]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1CN(CC)CC)cccc2

STK548720
Synonyms: (3aR,4S,9aR,9bS)- 4- [(4- chlorophenyl)carbonyl]- 2- (2- methyl- 5- nitrophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1C)[N+](=O)[O-])C(=O)c1ccccc1

STK548722
Synonyms: N'- [(E)- {3- ethoxy- 4- [(4- fluorobenzyl)oxy]phenyl}methylidene]- 2- (5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)Cn2nc(cc2C)[N+](=O)[O-])ccc1OCc1ccc(cc1)F

STK548723
Synonyms: 3- {[3- (morpholin- 4- yl)propyl]amino}- 1- (4- propoxyphenyl)pyrrolidine- 2,5- dione
Smiles: CCCOc1ccc(cc1)N1C(=O)CC(C1=O)NCCCN1CCOCC1

STK548724
Synonyms: (6aS,6bR,9aS,10R)- 10- [(3- bromo- 4- methoxyphenyl)carbonyl]- 8- (3,5- dichlorophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1cc(Cl)cc(c1)Cl)C=Cc1c2cccc1

STK548725
Synonyms: 4- (phenylcarbonyl)phenyl(6aS,6bR,9aS,10R)- 8- (2,4- dichlorophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxylate
Smiles: O=C([C@H]1[C@@H]2[C@H]([C@H]3N1c1ccccc1C=C3)C(=O)N(C2=O)c1ccc(cc1Cl)Cl)Oc1ccc(cc1)C(=O)c1ccccc1

STK548727
Synonyms: (5E)- 2- [4- (4- methylphenyl)piperazin- 1- yl]- 5- {2- [(4- nitrobenzyl)oxy]benzylidene}- 1,3- thiazol- 4(5H)- one
Smiles: Cc1ccc(cc1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccccc2OCc2ccc(cc2)[N+](=O)[O-])/S1

STK548728
Synonyms: 3- (2- bromophenoxy)- 8- [(2- ethylpiperidin- 1- yl)methyl]- 7- hydroxy- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CCC1CCCCN1Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccccc1Br)C(F)(F)F

STK548729
Synonyms: 2- [(6- amino- 3,5- dicyanopyridin- 2- yl)sulfanyl]- N- [4- (trifluoromethoxy)phenyl]acetamide
Smiles: N#Cc1cc(C#N)c(nc1SCC(=O)Nc1ccc(cc1)OC(F)(F)F)N

STK548731
Synonyms: N- (3- cyano- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl)- 2- {[3- cyano- 4- (4- methoxyphenyl)- 5,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1c(C#N)c(SCC(=O)Nc2sc3c(c2C#N)CCC3)nc2c1CCCC2

STK548732
Synonyms: 3- (4- bromophenyl)- 6- iodo- 2- [(E)- 2- (5- nitrofuran- 2- yl)ethenyl]quinazolin- 4(3H)- one
Smiles: Brc1ccc(cc1)n1c(/C=C/c2ccc(o2)[N+](=O)[O-])nc2c(c1=O)cc(cc2)I

STK548733
Synonyms: 5- (2- acetyl- 1,2,3,4- tetrahydroisoquinolin- 1- yl)- 3- (3,4- dimethylphenyl)- 6- hydroxypyrimidine- 2,4(1H,3H)- dione
Smiles: CC(=O)N1CCc2c(C1c1c(O)[nH]c(=O)n(c1=O)c1ccc(c(c1)C)C)cccc2

STK548735
Synonyms: N- (2- {(2Z)- 2- [1- (3- cyanopropyl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]hydrazinyl}- 2- oxoethyl)- 2- iodobenzamide(non- preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)c2ccccc2I)/c2c1cccc2

STK548738
Synonyms: (1'S,2'S,3S)- 2'- [(4- bromophenyl)carbonyl]- N- (4- chlorophenyl)- 2- oxo- 1,1',2,2'- tetrahydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinoline]- 1'- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)[C@H]1N2c3ccccc3C=CC2[C@@]2([C@@H]1C(=O)c1ccc(cc1)Br)C(=O)Nc1c2cccc1

STK548739
Synonyms: 2- methoxyethyl2- amino- 1- (2- methylpropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)CC(C)C

STK548742
Synonyms: [5- (2- chlorophenyl)furan- 2- yl][4- (diphenylmethyl)piperazin- 1- yl]methanethione
Smiles: S=C(c1ccc(o1)c1ccccc1Cl)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK548743
Synonyms: 2- {[6- amino- 3,5- dicyano- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (3,4- dichlorobenzyl)acetamide
Smiles: N#Cc1c(SCC(=O)NCc2ccc(c(c2)Cl)Cl)nc(c(c1c1cccs1)C#N)N

STK548744
Synonyms: methyl[6- bromo- 2- (2- hydroxy- 5- methoxy- 3- nitrophenyl)- 4- phenyl- 1,4- dihydroquinazolin- 3(2H)- yl]acetate
Smiles: COC(=O)CN1C(c2ccccc2)c2cc(Br)ccc2NC1c1cc(OC)cc(c1O)[N+](=O)[O-]

STK548745
Synonyms: 3- chloro- 4- [(4- chlorophenyl)amino]- 1- (2- phenylethyl)- 1H- pyrrole- 2,5- dione
Smiles: Clc1ccc(cc1)NC1=C(Cl)C(=O)N(C1=O)CCc1ccccc1

STK548746
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- bromo- 4- [(2- fluorobenzyl)oxy]- 5- methoxyphenyl}methylidene]- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CNc2ccccc2)c2nonc2N)cc(c1OCc1ccccc1F)Br

STK548747
Synonyms: N- (3- methoxyphenyl)- 2- ({5- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(s1)SCc1cccc2c1cccc2

STK548748
Synonyms: methyl4- {6- [(3- chloro- 4- methoxyphenyl)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)OC)nc1c2cccc1

STK548749
Synonyms: 2- [4- (2- hydroxyethyl)piperazin- 1- yl]- 3- [(Z)- (4- oxo- 3- pentyl- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)CCO)/C1=O

STK548751
Synonyms: N- (3- cyano- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl)- 2- [(3- cyano- 5- ethyl- 4,6- dimethylpyridin- 2- yl)sulfanyl]acetamide
Smiles: N#Cc1c(SCC(=O)Nc2sc3c(c2C#N)CCC3)nc(c(c1C)CC)C

STK548752
Synonyms: 5- phenyl- 3- (propylsulfanyl)- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCCSc1nnc2n1c(nc1c2c2CCCc2s1)c1ccccc1

STK548753
Synonyms: N- [1- (1H- benzimidazol- 2- yl)- 3- (methylsulfanyl)propyl]thiophene- 2- carboxamide
Smiles: CSCCC(c1nc2c([nH]1)cccc2)NC(=O)c1cccs1

STK548754
Synonyms: 2- [(2- ethyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)sulfanyl]- N- (4- phenylbutan- 2- yl)acetamide
Smiles: CCc1nc(SCC(=O)NC(CCc2ccccc2)C)c2c(n1)sc1c2CCCC1

STK548755
Synonyms: 1,1'- piperazine- 1,4- diylbis{3- [(1- bromonaphthalen- 2- yl)oxy]propan- 2- ol}
Smiles: OC(CN1CCN(CC1)CC(COc1ccc2c(c1Br)cccc2)O)COc1ccc2c(c1Br)cccc2

STK548756
Synonyms: 3- (naphthalen- 1- yl)- 2- phenyltetrahydro- 1H,5H- pyrazolo[1,2- a][1,2,4]triazole- 1- thione
Smiles: S=C1N2CCCN2C(N1c1ccccc1)c1cccc2c1cccc2

STK548758
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (3- methoxyphenyl)ethanone
Smiles: COc1cccc(c1)C(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1

STK548760
Synonyms: (5E)- 2- [4- (naphthalen- 1- yl)piperazin- 1- yl]- 5- {2- [(4- nitrobenzyl)oxy]benzylidene}- 1,3- thiazol- 4(5H)- one
Smiles: O=C1N=C(S/C/1=C/c1ccccc1OCc1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)c1cccc2c1cccc2

STK548761
Synonyms: ethyl6- amino- 5- cyano- 2- {[(4- cyano- 1- ethyl- 5,6,7,8- tetrahydroisoquinolin- 3- yl)methyl]sulfanyl}- 4- (3,4- dimethoxyphenyl)- 4H- pyran- 3- carboxylate
Smiles: CCOC(=O)C1=C(SCc2nc(CC)c3c(c2C#N)CCCC3)OC(=C(C1c1ccc(c(c1)OC)OC)C#N)N

STK548762
Synonyms: ethyl2- ({[(3,4,5- trimethoxyphenyl)carbonyl]carbamothioyl}amino)- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2cc(OC)c(c(c2)OC)OC)sc2c1CCCCC2

STK548764
Synonyms: 2- [(4- amino- 7- methyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N,N- dibutylacetamide
Smiles: CCCCN(C(=O)CSc1nc(N)c2c(n1)sc1c2CCC(C1)C)CCCC

STK548765
Synonyms: 4- (phenylcarbonyl)phenyl(6aS,6bR,9aS,10R)- 8- (1,3- benzodioxol- 5- yl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxylate
Smiles: O=C([C@H]1[C@@H]2[C@H]([C@H]3N1c1ccccc1C=C3)C(=O)N(C2=O)c1ccc2c(c1)OCO2)Oc1ccc(cc1)C(=O)c1ccccc1

STK548766
Synonyms: 5- (phenylamino)- 3- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}- 6H- anthra[1,9- cd][1,2]oxazol- 6- one
Smiles: O=C1c2ccccc2c2c3c1c(Nc1ccccc1)cc(c3no2)N1CCN(CC1)c1cccc(c1)C(F)(F)F

STK548768
Synonyms: 3- [4- (decyloxy)phenyl]- 1- ethoxyquinoxalin- 2(1H)- one4- oxide
Smiles: CCCCCCCCCCOc1ccc(cc1)c1[n+]([O-])c2ccccc2n(c1=O)OCC

STK548769
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(diethylamino)methyl]- N'- [(E)- {3- [(4- fluorobenzyl)oxy]phenyl}methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)OCc1ccc(cc1)F)CC

STK548770
Synonyms: 3- (2,5- dibromophenyl)- 6- iodo- 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-])c1cc(Br)ccc1Br

STK548771
Synonyms: N- {1- [1- (4- tert- butyl- 2,6- dimethylbenzyl)- 1H- benzimidazol- 2- yl]- 3- (methylsulfanyl)propyl}benzamide
Smiles: CSCCC(c1nc2c(n1Cc1c(C)cc(cc1C)C(C)(C)C)cccc2)NC(=O)c1ccccc1

STK548772
Synonyms: (4Z)- 4- (3- bromo- 4,5- diethoxybenzylidene)- 2- (2- fluorophenyl)- 1,3- oxazol- 5(4H)- one
Smiles: CCOc1cc(/C=C/2\N=C(OC2=O)c2ccccc2F)cc(c1OCC)Br

STK548773
Synonyms: 11- (4- methoxybenzyl)- 3- (2- methoxyphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccc(cc1)Cn1c2ncn(c(=O)c2c2c1nc1ccccc1n2)c1ccccc1OC

STK548774
Synonyms: 3- bromo- N- (4- fluorophenyl)- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1coc(=O)c(c1)Br

STK548775
Synonyms: 4- (2,3- dichlorophenyl)- 5- phenyl- 2- [3- (phenylethynyl)phenyl]- 1H- imidazole
Smiles: Clc1cccc(c1Cl)c1nc([nH]c1c1ccccc1)c1cccc(c1)C#Cc1ccccc1

STK548776
Synonyms: N- [1- (1H- benzimidazol- 2- yl)butyl]- 5- bromofuran- 2- carboxamide
Smiles: CCCC(c1nc2c([nH]1)cccc2)NC(=O)c1ccc(o1)Br

STK548777
Synonyms: 3- (2- methyl- 5- nitrophenyl)- 2- [(E)- 2- (4- nitrophenyl)ethenyl]quinazolin- 4(3H)- one
Smiles: [O-][N+](=O)c1ccc(cc1)/C=C/c1nc2ccccc2c(=O)n1c1cc(ccc1C)[N+](=O)[O-]

STK548778
Synonyms: (3aR,4S,9aR,9bS)- 4- [(4- chlorophenyl)carbonyl]- 2- (2,4- dichlorophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1Cl)Cl)C(=O)c1ccccc1

STK548779
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(1E)- 1- (3,4- dichlorophenyl)ethylidene]- 5- (piperidin- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN1CCCCC1)c1nonc1N)N/N=C(/c1ccc(c(c1)Cl)Cl)\C

STK548780
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- ethoxy- 4- [(3- fluorobenzyl)oxy]phenyl}methylidene]- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)ccc1OCc1cccc(c1)F

STK548783
Synonyms: 3- [5- (2- bromo- 4- methylphenoxy)pentyl]- 2- (4- chlorophenyl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCOc1ccc(cc1Br)C

STK548784
Synonyms: 3- butyl- 2- (ethylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: CCCCn1c(SCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548785
Synonyms: propan- 2- yl2- amino- 1- (4- ethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCOc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)OC(C)C

STK548786
Synonyms: 1- benzyl- 2- {[(5- bromofuran- 2- yl)carbonyl]amino}- N- (2- methoxyethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COCCNC(=O)c1c(NC(=O)c2ccc(o2)Br)n(c2c1nc1ccccc1n2)Cc1ccccc1

STK548787
Synonyms: 3- methyl- 1- (4- methylpiperazin- 1- yl)- 2- phenylbutan- 1- one
Smiles: CC(C(C(=O)N1CCN(CC1)C)c1ccccc1)C

STK548788
Synonyms: (1Z)- N'- {[2- (2,4- dichlorophenoxy)propanoyl]oxy}- 2- (3,4- dimethoxyphenyl)ethanimidamide
Smiles: COc1cc(ccc1OC)C/C(=N/OC(=O)C(Oc1ccc(cc1Cl)Cl)C)/N

STK548789
Synonyms: 3- tert- butyl- 7- {[2- (4- phenylpiperazin- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: O=c1c2ccccc2c(=O)c2c1c(NCCN1CCN(CC1)c1ccccc1)cc1c2[nH]c2c(o1)cc(cc2)C(C)(C)C

STK548790
Synonyms: 1,3- bis(2- methoxyphenyl)- 5- [(piperidin- 1- ylamino)methylidene]- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: COc1ccccc1N1C(=O)/C(=C/NN2CCCCC2)/C(=O)N(C1=S)c1ccccc1OC

STK548791
Synonyms: 2- imino- N- (2- methoxyethyl)- 5- oxo- 1- (2- phenylethyl)- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: COCCNC(=O)c1cc2c(n(c1=N)CCc1ccccc1)nc1n(c2=O)cccc1

STK548793
Synonyms: 2- [(4- amino- 7- methyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- (furan- 2- ylmethyl)acetamide
Smiles: CC1CCc2c(C1)sc1c2c(N)nc(n1)SCC(=O)NCc1ccco1

STK548794
Synonyms: prop- 2- en- 1- yl2- amino- 1- (2- methoxyethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: COCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)OCC=C

STK548795
Synonyms: 3- (4- methylphenyl)- 10- [(2E)- 3- phenylprop- 2- enoyl]- 11- (pyridin- 3- yl)- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: Cc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cccnc1)C(=O)/C=C/c1ccccc1

STK548796
Synonyms: 6- {3- acetyl- 2- [4- (dimethylamino)phenyl]- 4- hydroxy- 5- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl}hexanoicacid
Smiles: OC(=O)CCCCCN1C(c2ccc(cc2)N(C)C)C(=C(C1=O)O)C(=O)C

STK548798
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- {(E)- [2- (benzyloxy)- 3- methoxyphenyl]methylidene}- 5- (piperidin- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cccc(c1OCc1ccccc1)/C=N/NC(=O)c1nnn(c1CN1CCCCC1)c1nonc1N

STK548800
Synonyms: N- (2- {(2Z)- 2- [1- (3- cyanopropyl)- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]hydrazinyl}- 2- oxoethyl)- 2,2- diphenylacetamide(non- preferredname)
Smiles: N#CCCCN1C(=O)/C(=N\NC(=O)CNC(=O)C(c2ccccc2)c2ccccc2)/c2c1cccc2

STK548803
Synonyms: 2- methoxyethyl2- amino- 1- butyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)OCCOC

STK548805
Synonyms: (5E)- 2- [4- (3- chloro- 4- methylphenyl)piperazin- 1- yl]- 5- {4- [(4- nitrobenzyl)oxy]benzylidene}- 1,3- thiazol- 4(5H)- one
Smiles: O=C1N=C(S/C/1=C/c1ccc(cc1)OCc1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)c1ccc(c(c1)Cl)C

STK548806
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(1E)- 1- (3- bromophenyl)ethylidene]- 5- (piperidin- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Brc1cccc(c1)/C(=N/NC(=O)c1nnn(c1CN1CCCCC1)c1nonc1N)/C

STK548807
Synonyms: 4- [4- (benzyloxy)- 6- methyl- 5- nitropyrimidin- 2- yl]morpholine
Smiles: [O-][N+](=O)c1c(OCc2ccccc2)nc(nc1C)N1CCOCC1

STK548809
Synonyms: 2- ethoxy- 4- {(Z)- [5- oxo- 2- (thiophen- 2- yl)- 1,3- oxazol- 4(5H)- ylidene]methyl}phenylbutanoate
Smiles: CCCC(=O)Oc1ccc(cc1OCC)/C=C/1\N=C(OC1=O)c1cccs1

STK548810
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(1E)- 1- (2,5- dimethylthiophen- 3- yl)ethylidene]- 5- phenyl- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Cc1sc(c(c1)/C(=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N)/C)C

STK548811
Synonyms: 2- [(4- butyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl)sulfanyl]acetamide
Smiles: CCCCc1nc2sc3c(c2c2c1CCC2)ncnc3SCC(=O)N

STK548813
Synonyms: 2- (4- methoxyphenyl)- 3- [2- (2,4,6- trichlorophenoxy)ethyl]quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCOc1c(Cl)cc(cc1Cl)Cl

STK548814
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {5- chloro- 2- [(2- chloro- 6- fluorobenzyl)oxy]phenyl}methylidene]- 5- [(diethylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(Cl)ccc1OCc1c(F)cccc1Cl)CC

STK548815
Synonyms: 2- amino- 1- (3- chloro- 4- methoxyphenyl)- N- (furan- 2- ylmethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccc(cc1Cl)n1c2nc3ccccc3nc2c(c1N)C(=O)NCc1ccco1

STK548817
Synonyms: 4- acetyl- 1- hexadecyl- 3- hydroxy- 5- (4- methylphenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CCCCCCCCCCCCCCCCN1C(=O)C(=C(C1c1ccc(cc1)C)C(=O)C)O

STK548818
Synonyms: 3- [2- amino- 3- (butoxycarbonyl)- 1H- pyrrolo[2,3- b]quinoxalin- 1- yl]benzoicacid
Smiles: CCCCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)C(=O)O

STK548819
Synonyms: (9E)- 9- [4- (difluoromethoxy)benzylidene]- 5- [4- (difluoromethoxy)phenyl]- 3- (4- nitrophenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: FC(Oc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)[N+](=O)[O-])/C(=C/c1ccc(cc1)OC(F)F)/CCC2)F

STK548820
Synonyms: N- (4- bromophenyl)- 2- {[3- (2- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCC3

STK548821
Synonyms: 2- imino- N- (2- methoxyethyl)- 1- methyl- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: COCCNC(=O)c1cc2c(n(c1=N)C)nc1n(c2=O)cccc1

STK548823
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {5- chloro- 2- [(2,6- dichlorobenzyl)oxy]phenyl}methylidene]- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Clc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N)OCc1c(Cl)cccc1Cl

STK548824
Synonyms: 3- {3- hydroxy- 4- [(4- methylphenyl)carbonyl]- 5- (4- nitrophenyl)- 2- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl}benzoicacid
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1cccc(c1)C(=O)O

STK548825
Synonyms: 3- amino- N- (4- chlorophenyl)- 6- methyl- 4- (thiophen- 2- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1sc2c(c1N)c(cc(n2)C)c1cccs1

STK548826
Synonyms: 2- methoxy- 4- {(E)- [2- ({[4- (4- methoxyphenyl)- 5- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenylacetate
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2c2ccc(cc2)OC)c2ccc(cc2)C)ccc1OC(=O)C

STK548827
Synonyms: N- {1- (3- methoxypropyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}- 4- nitrobenzenesulfonamide
Smiles: COCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)[N+](=O)[O-])S(=O)(=O)c1ccc(cc1)C

STK548829
Synonyms: 1- [(2,6- difluorobenzyl)oxy]- 3- (naphthalen- 1- yl)quinoxalin- 2(1H)- one4- oxide
Smiles: Fc1cccc(c1COn1c(=O)c(c2cccc3c2cccc3)[n+](c2c1cccc2)[O-])F

STK548830
Synonyms: [3- (3- benzylpyridinium- 1- yl)- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl][(4- bromophenyl)sulfonyl]azanide
Smiles: Brc1ccc(cc1)S(=O)(=O)[N-]C1=C([n+]2cccc(c2)Cc2ccccc2)C(=O)c2c(C1=O)cccc2

STK548831
Synonyms: 4- (2,5- dimethoxyphenyl)- 5- (quinolin- 2- yl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: COc1ccc(cc1n1c(S)nnc1c1ccc2c(n1)cccc2)OC

STK548832
Synonyms: 3- [3- (2- chloro- 5- methylphenoxy)propyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCOc1cc(C)ccc1Cl

STK548834
Synonyms: 2- {[6- amino- 3,5- dicyano- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- [2- (4- fluorophenyl)ethyl]acetamide
Smiles: N#Cc1c(SCC(=O)NCCc2ccc(cc2)F)nc(c(c1c1cccs1)C#N)N

STK548835
Synonyms: 4- [(8R,8aS,11aR)- 9,11- dioxo- 8- (phenylcarbonyl)- 8a,9,11a,11b- tetrahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazin- 10(11H)- yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1C2c2ccccc2C=N1)C(=O)c1ccccc1

STK548836
Synonyms: ethyl4- [11- (4- methoxyphenyl)- 4- oxo- 4,11- dihydro- 3H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 3- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)OC

STK548837
Synonyms: N,N'- bis(1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 9H- fluorene- 2,7- disulfonamide
Smiles: Cc1c(NS(=O)(=O)c2ccc3c(c2)Cc2c3ccc(c2)S(=O)(=O)Nc2c(C)n(n(c2=O)c2ccccc2)C)c(=O)n(n1C)c1ccccc1

STK548838
Synonyms: methyl[3- (4- benzylpiperidin- 1- yl)quinoxalin- 2- yl](cyano)acetate
Smiles: COC(=O)C(c1nc2ccccc2nc1N1CCC(CC1)Cc1ccccc1)C#N

STK548839
Synonyms: ethyl4,5- dimethyl- 2- {[(pyridin- 3- ylcarbonyl)carbamothioyl]amino}thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2cccnc2)sc(c1C)C

STK548840
Synonyms: prop- 2- en- 1- yl2- amino- 1- (2,4- dimethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: C=CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1OC)OC

STK548841
Synonyms: 2- amino- 1- (4- methoxybenzyl)- N- (2- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccc(cc1)Cn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1ccccc1OC

STK548843
Synonyms: N'- [(1,3- dimethyl- 4,6- dioxo- 2- thioxotetrahydropyrimidin- 5(2H)- ylidene)methyl]pyridine- 4- carbohydrazide
Smiles: CN1C(=S)N(C)C(=O)C(=CNNC(=O)c2ccncc2)C1=O

STK548844
Synonyms: (8S,8aR,11aS)- 8- [(4- methoxyphenyl)carbonyl]- 10- phenyl- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1)cccc3

STK548845
Synonyms: butyl[3- (4- carbamoylpiperidin- 1- yl)quinoxalin- 2- yl](cyano)acetate
Smiles: CCCCOC(=O)C(c1nc2ccccc2nc1N1CCC(CC1)C(=O)N)C#N

STK548846
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- [(2,4- dichlorobenzyl)oxy]phenyl}methylidene]- 5- [(4- methylpiperazin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CN1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)OCc1ccc(cc1Cl)Cl

STK548847
Synonyms: 3- amino- 6- ethyl- N- (4- methyl- 1,3- thiazol- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: CCC1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)Nc1scc(n1)C

STK548849
Synonyms: (2E)- 2- cyano- 3- [1- (2- fluorophenyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]- N- (thiophen- 2- ylmethyl)prop- 2- enamide
Smiles: N#C/C(=C\c1cc(n(c1C)c1ccccc1F)C)/C(=O)NCc1cccs1

STK548850
Synonyms: N~2~,N~2~- diethyl- N- [4- methyl- 2- (phenylcarbonyl)phenyl]glycinamide
Smiles: CCN(CC(=O)Nc1ccc(cc1C(=O)c1ccccc1)C)CC

STK548851
Synonyms: 4- bromo- N- {1- (3- methoxypropyl)- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}benzenesulfonamide
Smiles: COCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)Br)S(=O)(=O)c1ccc(cc1)C

STK548853
Synonyms: 3- {(Z)- [3- (1,3- benzodioxol- 5- ylmethyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (diethylamino)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCN(c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2)CC

STK548854
Synonyms: 2- {(E)- [2- ({1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- [(4- methylpiperazin- 1- yl)methyl]- 1H- 1,2,3- triazol- 4- yl}carbonyl)hydrazinylidene]methyl}- 6- methoxyphenylbenzoate
Smiles: COc1cccc(c1OC(=O)c1ccccc1)/C=N/NC(=O)c1nnn(c1CN1CCN(CC1)C)c1nonc1N

STK548855
Synonyms: 4- {[1,1,1,3,3,3- hexafluoro- 2- (methoxycarbonyl)propan- 2- yl]sulfanyl}- 3- methylphenylbenzoate
Smiles: COC(=O)C(C(F)(F)F)(C(F)(F)F)Sc1ccc(cc1C)OC(=O)c1ccccc1

STK548856
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {2- [(3- fluorobenzyl)oxy]- 5- nitrophenyl}methylidene]- 5- [(4- methylpiperazin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CN1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(ccc1OCc1cccc(c1)F)[N+](=O)[O-]

STK548858
Synonyms: 2- {[3- cyano- 6- (4- methoxyphenyl)- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (3- ethoxyphenyl)acetamide
Smiles: CCOc1cccc(c1)NC(=O)CSc1nc(cc(c1C#N)c1cccs1)c1ccc(cc1)OC

STK548859
Synonyms: propan- 2- yl2- amino- 1- pentyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCCn1c2nc3ccccc3nc2c(c1N)C(=O)OC(C)C

STK548860
Synonyms: 2- {[6- amino- 3,5- dicyano- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- [2- chloro- 5- (trifluoromethyl)phenyl]acetamide
Smiles: N#Cc1c(SCC(=O)Nc2cc(ccc2Cl)C(F)(F)F)nc(c(c1c1cccs1)C#N)N

STK548861
Synonyms: butylcyano{3- [4- (diphenylmethyl)piperazin- 1- yl]quinoxalin- 2- yl}acetate
Smiles: CCCCOC(=O)C(c1nc2ccccc2nc1N1CCN(CC1)C(c1ccccc1)c1ccccc1)C#N

STK548862
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- [(4- chlorobenzyl)oxy]phenyl}methylidene]- 5- [(phenylamino)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Clc1ccc(cc1)COc1cccc(c1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N

STK548866
Synonyms: methyl5- bromo- 3- [(3,3- diphenylpropanoyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CC(c1ccccc1)c1ccccc1)cc(cc2)Br

STK548867
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (2- fluorophenyl)methylidene]- 5- (methoxymethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1F

STK548868
Synonyms: (5E)- 5- (4- butoxybenzylidene)- 2- (4- phenylpiperazin- 1- yl)- 1,3- thiazol- 4(5H)- one
Smiles: CCCCOc1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccccc1

STK548869
Synonyms: 3- (4- chlorophenyl)- 11- [4- (dimethylamino)phenyl]- 10- (phenylacetyl)- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: Clc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1ccc(cc1)N(C)C)C(=O)Cc1ccccc1

STK548870
Synonyms: 5- (biphenyl- 4- yl)- 2- (3- bromo- 4- fluorophenyl)- 4- phenyl- 1H- imidazole
Smiles: Fc1ccc(cc1Br)c1nc(c([nH]1)c1ccc(cc1)c1ccccc1)c1ccccc1

STK548871
Synonyms: 3- methoxybenzylN'- cyano- N- [3- (trifluoromethyl)phenyl]carbamimidothioate
Smiles: N#C/N=C(/Nc1cccc(c1)C(F)(F)F)\SCc1cccc(c1)OC

STK548873
Synonyms: 2- (4- fluorophenyl)- 5,5- dimethyl- 4- (pyridin- 2- yl)- 2,5- dihydro- 1H- imidazol- 1- ol3- oxide
Smiles: Fc1ccc(cc1)C1[N+](=C(C(N1O)(C)C)c1ccccn1)[O-]

STK548874
Synonyms: 4- bromo- N- {(5Z)- 5- [4- (octyloxy)benzylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}benzamide
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)Br

STK548875
Synonyms: 1- methyl- 7- {[2- (3- methylpiperidin- 1- yl)ethyl]amino}- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: CC1CCCN(C1)CCNc1cc2oc3cccc(c3[nH]c2c2c1c(=O)c1ccccc1c2=O)C

STK548877
Synonyms: ethyl5- cyano- 4- [4- (methoxycarbonyl)phenyl]- 2- methyl- 6- [(2- oxo- 2- phenylethyl)sulfanyl]- 1,4- dihydropyridine- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)C(=O)OC)C#N)SCC(=O)c1ccccc1

STK548878
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- ({5- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(s1)SCc1cccc2c1cccc2

STK548879
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {3- methoxy- 4- [(4- methylbenzyl)oxy]phenyl}methylidene]- 5- (piperidin- 1- ylmethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCCCC2)c2nonc2N)ccc1OCc1ccc(cc1)C

STK548880
Synonyms: [3- (3,5- dimethylpiperidin- 1- yl)quinoxalin- 2- yl][(4- methylphenyl)sulfonyl]acetonitrile
Smiles: N#CC(S(=O)(=O)c1ccc(cc1)C)c1nc2ccccc2nc1N1CC(C)CC(C1)C

STK548881
Synonyms: 2- ({5- [(4- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)- N'- [(1E)- 1- (naphthalen- 1- yl)ethylidene]acetohydrazide
Smiles: O=C(N/N=C(/c1cccc2c1cccc2)\C)CSc1nnc(s1)SCc1ccc(cc1)Cl

STK548882
Synonyms: ethyl4- [(4- chloro- 2- methylphenyl)amino]- 2- methylquinoline- 6- carboxylate
Smiles: CCOC(=O)c1ccc2c(c1)c(cc(n2)C)Nc1ccc(cc1C)Cl

STK548883
Synonyms: 2- {[4- (4- bromophenyl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(n1c1ccc(cc1)Br)c1cccnc1

STK548884
Synonyms: (8S,8aR,11aS)- 8- [(4- methoxyphenyl)carbonyl]- 10- (2- methyl- 5- nitrophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1C)[N+](=O)[O-])cccc3

STK548886
Synonyms: N- [3- cyano- 1- (4- methylphenyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl]propanamide
Smiles: CCC(=O)Nc1c(C#N)c2c(n1c1ccc(cc1)C)nc1c(n2)cccc1

STK548887
Synonyms: N- cyclohexyl- 4- {[2- (4- propoxyphenyl)quinazolin- 4- yl]oxy}benzamide
Smiles: CCCOc1ccc(cc1)c1nc(Oc2ccc(cc2)C(=O)NC2CCCCC2)c2c(n1)cccc2

STK548888
Synonyms: (2E)- 3- (3,4- dimethoxyphenyl)- N- ({4- [(5- ethyl- 1,3,4- thiadiazol- 2- yl)sulfamoyl]phenyl}carbamothioyl)prop- 2- enamide
Smiles: COc1cc(/C=C/C(=O)NC(=S)Nc2ccc(cc2)S(=O)(=O)Nc2nnc(s2)CC)ccc1OC

STK548889
Synonyms: (3aR,4S,9aR,9bS)- 4- [(3- bromo- 4- methoxyphenyl)carbonyl]- 2- (3- fluorophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)F)C(=O)c1ccccc1

STK548895
Synonyms: 2'- [({[(9Z)- 10- oxophenanthren- 9(10H)- ylidene]amino}oxy)carbonyl]biphenyl- 2- carbonitrile
Smiles: N#Cc1ccccc1c1ccccc1C(=O)O/N=C/1\C(=O)c2ccccc2c2c1cccc2

STK548897
Synonyms: N- (3- methoxyphenyl)- 2- [(4- oxo- 3- propyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCCn1c(SCC(=O)Nc2cccc(c2)OC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548898
Synonyms: 4- [(4- chlorophenyl)carbonyl]- 3- hydroxy- 5- (4- methoxyphenyl)- 1- (prop- 2- en- 1- yl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: C=CCN1C(c2ccc(cc2)OC)C(=C(C1=O)O)C(=O)c1ccc(cc1)Cl

STK548899
Synonyms: methyl2- ({[(5- methyl- 3- phenyl- 1,2- oxazol- 4- yl)carbonyl]carbamothioyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC(=S)NC(=O)c2c(C)onc2c2ccccc2)sc2c1CCCC2

STK548900
Synonyms: 1- {(2Z)- 2- [3- chloro- 5- (4- fluorophenyl)- 2- (4- methylphenyl)- 1- benzoxepin- 4(5H)- ylidene]ethyl}piperidine
Smiles: Cc1ccc(cc1)C1=C(Cl)/C(=C\CN2CCCCC2)/C(c2c(O1)cccc2)c1ccc(cc1)F

STK548901
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- {4- [(4- chlorobenzyl)oxy]- 3- methoxyphenyl}methylidene]- 5- [(4- methylpiperidin- 1- yl)methyl]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)ccc1OCc1ccc(cc1)Cl

STK548903
Synonyms: (5Z)- 2- [(3- bromophenyl)amino]- 5- (4- ethoxy- 3- methoxybenzylidene)- 1,3- thiazol- 4(5H)- one
Smiles: CCOc1ccc(cc1OC)/C=C/1\SC(=NC1=O)Nc1cccc(c1)Br

STK548904
Synonyms: [5- (4- bromophenyl)- 1',3'- diphenyl- 3,4- dihydro- 1'H,2H- 3,4'- bipyrazol- 2- yl](furan- 2- yl)methanone
Smiles: Brc1ccc(cc1)C1=NN(C(C1)c1cn(nc1c1ccccc1)c1ccccc1)C(=O)c1ccco1

STK548905
Synonyms: 2- {2- [(4- amino- 6- propyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]ethyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: CCCC1OCc2c(C1)c1c(N)nc(nc1s2)SCCN1C(=O)c2c(C1=O)cccc2

STK548906
Synonyms: (5Z)- 1- (4- fluorophenyl)- 5- ({1- [3- (3- methoxyphenoxy)propyl]- 1H- indol- 3- yl}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1cccc(c1)OCCCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)F

STK548907
Synonyms: 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}- N- (2- methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCC3

STK548908
Synonyms: ethyl3- ({2- [4- (3- chlorophenyl)piperazin- 1- yl]propanoyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(CC1)c1cccc(c1)Cl)C)cccc2

STK548909
Synonyms: 5- (4- chlorophenyl)- 3- (3,4- dimethoxyphenyl)- 1- [(4- methylphenyl)sulfonyl]- 4,5- dihydro- 1H- pyrazole
Smiles: COc1ccc(cc1OC)C1=NN(C(C1)c1ccc(cc1)Cl)S(=O)(=O)c1ccc(cc1)C

STK548910
Synonyms: (2E,5Z)- 5- (thiophen- 2- ylmethylidene)- 2- {[3- (trifluoromethyl)phenyl]imino}- 1,3- thiazolidin- 4- one
Smiles: O=C1N/C(=N\c2cccc(c2)C(F)(F)F)/S/C/1=C\c1cccs1

STK548911
Synonyms: (8R,8aS,11aR)- 10- (4- 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)c1ccc(cc1)Br)cccc3

STK548912
Synonyms: 2- methoxy- 6- {4- [(4- methoxyphenyl)amino]quinazolin- 2- yl}phenol
Smiles: COc1ccc(cc1)Nc1nc(nc2c1cccc2)c1cccc(c1O)OC

STK548913
Synonyms: 11- (1,3- benzodioxol- 5- ylmethyl)- 3- hexyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccc2c(c1)OCO2

STK548914
Synonyms: (5Z)- 3- (2- bromophenyl)- 5- (1H- indol- 3- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\c2c[nH]c3c2cccc3)/C(=O)N1c1ccccc1Br

STK548915
Synonyms: 6- ethyl- 6- methyl- 2- (methylsulfanyl)- 4- [(naphthalen- 2- ylmethyl)sulfanyl]- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCC1(C)OCc2c(C1)c1c(SCc3ccc4c(c3)cccc4)nc(nc1s2)SC

STK548917
Synonyms: 2- (4- chlorophenyl)- 3- [4- (2- iodophenoxy)butyl]quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1ccccc1I

STK548918
Synonyms: 2- (4- {4- [(3- bromophenyl)amino]phthalazin- 1- yl}phenoxy)- 1- (piperidin- 1- yl)ethanone
Smiles: Brc1cccc(c1)Nc1nnc(c2c1cccc2)c1ccc(cc1)OCC(=O)N1CCCCC1

STK548919
Synonyms: N- (4- ethoxyphenyl)- 11- (furan- 2- yl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccco2)c(nn1c1ccccc1)C

STK548920
Synonyms: N- benzyl- 2- [(3- ethyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: CCn1c(SCC(=O)NCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK548921
Synonyms: N- benzyl- 2,2- dichloro- 1- phenylcyclopropanecarboxamide
Smiles: O=C(C1(CC1(Cl)Cl)c1ccccc1)NCc1ccccc1

STK548922
Synonyms: 2- (benzylsulfanyl)- 3- (3- methylphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: Cc1cccc(c1)n1c(SCc2ccccc2)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK548923
Synonyms: N- (2- fluorophenyl)- 5- nitro- 2- (piperidin- 1- yl)pyrimidine- 4,6- diamine
Smiles: [O-][N+](=O)c1c(N)nc(nc1Nc1ccccc1F)N1CCCCC1

STK548924
Synonyms: 3,4,5- trimethoxy- N- [(2- {[(1S,2S)- 2- phenylcyclopropyl]carbonyl}hydrazinyl)carbonothioyl]benzamide
Smiles: COc1c(OC)cc(cc1OC)C(=O)NC(=S)NNC(=O)[C@H]1C[C@@H]1c1ccccc1

STK548925
Synonyms: 2- [(3- fluorobenzyl)sulfanyl]- 6,6- dimethyl- 3- phenyl- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Fc1cccc(c1)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(OC3)(C)C

STK548926
Synonyms: methyl2- [(3- {[(4- chlorophenyl)sulfonyl]amino}quinoxalin- 2- yl)amino]benzoate
Smiles: COC(=O)c1ccccc1Nc1nc2ccccc2nc1NS(=O)(=O)c1ccc(cc1)Cl

STK548927
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(1Z)- 1- (2- chlorophenyl)ethylidene]- 5- (phenoxymethyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Nc1nonc1n1nnc(c1COc1ccccc1)C(=O)N/N=C(\c1ccccc1Cl)/C

STK548928
Synonyms: 1- methoxypropan- 2- yl2- amino- 1- pentyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)OC(COC)C

STK548930
Synonyms: 2- amino- 1- (2- methylpropyl)- N- pentyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CC(C)C

STK548931
Synonyms: N'- (bicyclo[4.1.0]hept- 7- ylcarbonyl)- 3- bromo- 2- oxo- 2H- pyran- 5- carbohydrazide
Smiles: O=C(C1C2C1CCCC2)NNC(=O)c1coc(=O)c(c1)Br

STK548932
Synonyms: 1- amino- 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)Nc1ccccc1

STK548933
Synonyms: 1- amino- N- (4- chlorophenyl)- 5- (morpholin- 4- yl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1sc2c(c1N)c1CCCCc1c(n2)N1CCOCC1

STK548934
Synonyms: 1- (2,4- dinitronaphthalen- 1- yl)pyrrolidine
Smiles: [O-][N+](=O)c1cc([N+](=O)[O-])c2c(c1N1CCCC1)cccc2

STK548936
Synonyms: 2- {[5- (4- tert- butylphenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1E,2Z)- 2- chloro- 3- phenylprop- 2- en- 1- ylidene]acetohydrazide
Smiles: CCn1c(SCC(=O)N/N=C/C(=C/c2ccccc2)/Cl)nnc1c1ccc(cc1)C(C)(C)C