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

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STK538769
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1Z)- 1- (naphthalen- 2- yl)ethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C(\c1ccc2c(c1)cccc2)/C

STK538770
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (3- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cccc(c1)/C=N/NC(=O)CSc1nnc(n1C)c1ccc(cc1)Cl

STK538772
Synonyms: methyl2- {[4- (4- methylphenyl)- 5- oxo- 7- (propan- 2- yl)- 4,5,6,9- tetrahydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}propanoate
Smiles: COC(=O)C(Sc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CC(OC3)C(C)C)C

STK538774
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 3- (2- methylphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Clc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3

STK538776
Synonyms: 3- amino- 6,6- dimethyl- 2- (2- methylpropyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CC(Cc1nc2sc3c(c2c(=O)n1N)CC(OC3)(C)C)C

STK538777
Synonyms: 8- {[2- (diethylamino)ethyl]amino}- 1,3- dimethyl- 7- (propan- 2- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCN(CCNc1nc2c(n1C(C)C)c(=O)n(c(=O)n2C)C)CC

STK538778
Synonyms: (2E)- 2- [(6- methylpyridin- 2- yl)methylidene]- N- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)hydrazinecarboxamide
Smiles: O=C(NC12CC3CC(C2)CC(C1)C3)N/N=C/c1cccc(n1)C

STK538779
Synonyms: (5Z)- 1- (4- methylphenyl)- 5- (2,3,6,7- tetrahydro- 1H,5H- pyrido[3,2,1- ij]quinolin- 9- ylmethylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cc3CCCN4c3c(c2)CCC4)/C1=O

STK538780
Synonyms: (1'R,3R,3'R)- 1',3'- bis[(3,4- dimethoxyphenyl)carbonyl]- 3',3a'- dihydrospiro[indole- 3,2'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: COc1ccc(cc1OC)C(=O)[C@H]1C2C=Cc3c(N2[C@H]([C@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(c(c1)OC)OC)cccc3

STK538781
Synonyms: 4,6- dimethyl- 2- {(2Z)- 2- [1- (naphthalen- 2- yl)ethylidene]hydrazinyl}pyrimidine
Smiles: Cc1cc(C)nc(n1)N/N=C(\c1ccc2c(c1)cccc2)/C

STK538782
Synonyms: 9- chloro- 5- (4- methylphenyl)- 2- [4- (prop- 2- en- 1- yloxy)phenyl]- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: C=CCOc1ccc(cc1)C1=NN2C(C1)c1cc(Cl)ccc1OC2c1ccc(cc1)C

STK538783
Synonyms: N'- {4- cyano- 5- [2- (dimethylamino)ethyl]- 5H- pyrido[4,3- b]indol- 3- yl}- N,N- dimethylimidoformamide
Smiles: N#Cc1c(/N=C/N(C)C)ncc2c1n(CCN(C)C)c1c2cccc1

STK538784
Synonyms: (5Z)- 2- [4- (4- chlorophenyl)piperazin- 1- yl]- 5- {[5- (4- methylphenyl)furan- 2- yl]methylidene}- 1,3- thiazol- 4(5H)- one
Smiles: Cc1ccc(cc1)c1ccc(o1)/C=C/1\SC(=NC1=O)N1CCN(CC1)c1ccc(cc1)Cl

STK538785
Synonyms: 6- oxo- N- phenyl- 1,6- dihydropyridazine- 3- carboxamide
Smiles: O=C(c1ccc(=O)[nH]n1)Nc1ccccc1

STK538786
Synonyms: 3- methyl- 7- [(4- methylphenyl)amino]- 8H- naphtho[2,3- a]phenothiazine- 8,13(14H)- dione
Smiles: Cc1ccc(cc1)Nc1cc2sc3cc(C)ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1

STK538787
Synonyms: (1'R,3R,3'R)- 1'- [(4- bromophenyl)carbonyl]- 3'- (thiophen- 2- ylcarbonyl)- 3',3a'- dihydrospiro[indole- 3,2'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccs1

STK538788
Synonyms: 8- (cyclohexylamino)- 7- heptyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(NC2CCCCC2)nc2c1c(=O)[nH]c(=O)n2C

STK538789
Synonyms: 2- [(2E)- 2- (3- methoxybenzylidene)hydrazinyl]- 4,6- dimethylpyrimidine
Smiles: COc1cccc(c1)/C=N/Nc1nc(C)cc(n1)C

STK538790
Synonyms: 2,2,3,3,4,4,5,5,6,6,7,7,7- tridecafluoro- N- (1,3- thiazol- 2- yl)heptanamide
Smiles: O=C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Nc1nccs1

STK538793
Synonyms: 3- cyclohexyl- 2- [(2,4- dichlorobenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Clc1ccc(c(c1)Cl)CSc1nc2c3ccccc3CC3(c2c(=O)n1C1CCCCC1)CCCCC3

STK538794
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(E)- pyridin- 3- ylmethylidene]acetohydrazide
Smiles: O=C(Cn1nnnc1N)N/N=C/c1cccnc1

STK538796
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (4- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1C)c1cccc(c1)Br

STK538797
Synonyms: 2- cyclopropyl- N'- [(E)- (4- fluorophenyl)methylidene]quinoline- 4- carbohydrazide
Smiles: Fc1ccc(cc1)/C=N/NC(=O)c1cc(nc2c1cccc2)C1CC1

STK538799
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(E)- (3,4- dimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cn2nnnc2N)ccc1OC

STK538800
Synonyms: ethyl1- amino- 5- (2- methylpropyl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxylate
Smiles: CCOC(=O)c1sc2c(c1N)c1CCCCc1c(n2)CC(C)C

STK538801
Synonyms: 4- cyclohexyl- N- [4- (4,4- dimethyl- 3,5- diphenyl- 4,5- dihydro- 1H- pyrazol- 1- yl)benzyl]aniline
Smiles: CC1(C)C(=NN(C1c1ccccc1)c1ccc(cc1)CNc1ccc(cc1)C1CCCCC1)c1ccccc1

STK538802
Synonyms: (3E)- 3- (4- chlorobenzylidene)- 1,4,5- triphenyl- 1,3,4,5- tetrahydropyrrolo[3,4- b]pyrrole- 2,6- dione
Smiles: Clc1ccc(cc1)/C=C\1/C(=O)N(C2=C1C(c1ccccc1)N(C2=O)c1ccccc1)c1ccccc1

STK538804
Synonyms: 8- (heptylsulfanyl)- 2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CCCCCCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C

STK538807
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- naphthalen- 1- ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1cccc2c1cccc2

STK538808
Synonyms: 2- cyclopropyl- N'- [(1E)- 1- (4- nitrophenyl)ethylidene]quinoline- 4- carbohydrazide
Smiles: C/C(=N\NC(=O)c1cc(nc2c1cccc2)C1CC1)/c1ccc(cc1)[N+](=O)[O-]

STK538811
Synonyms: N- {[4- (carbamimidoylsulfamoyl)phenyl]carbamothioyl}- 2- (4- chlorophenyl)acetamide
Smiles: NC(=N)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)Cc1ccc(cc1)Cl

STK538812
Synonyms: (9E)- 3- (4- bromophenyl)- 9- (2- chlorobenzylidene)- 5- (2- chlorophenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: Brc1ccc(cc1)c1csc2=NC3=C(C(n12)c1ccccc1Cl)CCC/C/3=C\c1ccccc1Cl

STK538813
Synonyms: 2- {[3- (4- methoxyphenyl)- 4- oxo- 3,4,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N,N- dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CCCC3)CCC

STK538814
Synonyms: 8- [(2E)- 2- (2,4- dihydroxybenzylidene)hydrazinyl]- 7- ethyl- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(N/N=C/c2ccc(cc2O)O)nc2c1c(=O)n(c(=O)n2C)C

STK538815
Synonyms: 3- (butylsulfanyl)- 11- (propan- 2- yl)- 7,8,9,10- tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: CCCCSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)C(C)C

STK538816
Synonyms: 4- acetyl- 5- hydroxy- 3- phenylcyclohex- 4- ene- 1,1,2,2- tetracarbonitrile
Smiles: N#CC1(C#N)C(c2ccccc2)C(=C(CC1(C#N)C#N)O)C(=O)C

STK538817
Synonyms: 2- (phenoxymethyl)- 3- {[(E)- (3,4,5- trimethoxyphenyl)methylidene]amino}quinazolin- 4(3H)- one
Smiles: COc1cc(/C=N/n2c(COc3ccccc3)nc3c(c2=O)cccc3)cc(c1OC)OC

STK538819
Synonyms: 2,2,3,3,4,4,5,5,6,6,7,7,7- tridecafluoro- N- [4- (6- methyl- 1,3- benzothiazol- 2- yl)phenyl]heptanamide
Smiles: Cc1ccc2c(c1)sc(n2)c1ccc(cc1)NC(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

STK538820
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (3- phenoxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1cccc(c1)Oc1ccccc1

STK538821
Synonyms: 3- methyl- 7- [2- (piperidin- 1- yl)ethyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=c1[nH]c(=O)n(c2c1n(CCN1CCCCC1)cn2)C

STK538824
Synonyms: 8- [(2E)- 2- (4- methoxybenzylidene)hydrazinyl]- 1,3- dimethyl- 7- (4- methylbenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1ccc(cc1)C)c(=O)n(c(=O)n2C)C

STK538825
Synonyms: 3- (furan- 2- ylmethyl)- 11- (3- methoxyphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1cccc(c1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)Cc1ccco1

STK538827
Synonyms: 7,9- dichloro- 5- (4- chlorophenyl)- 2- (3,4- dimethoxyphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: COc1ccc(cc1OC)C1=NN2C(C1)c1cc(Cl)cc(c1OC2c1ccc(cc1)Cl)Cl

STK538829
Synonyms: N'- (1- benzyl- 1H- pyrazolo[3,4- d]pyrimidin- 4- yl)- 2- chlorobenzohydrazide
Smiles: O=C(c1ccccc1Cl)NNc1ncnc2c1cnn2Cc1ccccc1

STK538830
Synonyms: 2- cyclopropyl- N'- [(E)- (2- methoxyphenyl)methylidene]quinoline- 4- carbohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)c1cc(nc2c1cccc2)C1CC1

STK538831
Synonyms: (2E)- N- (2,4- dichlorophenyl)- 2- (3- methoxybenzylidene)hydrazinecarbothioamide
Smiles: COc1cccc(c1)/C=N/NC(=S)Nc1ccc(cc1Cl)Cl

STK538832
Synonyms: 2- {1- [4- (dimethylamino)phenyl]- 5- oxo- 3- (2- phenylethyl)- 2- thioxoimidazolidin- 4- yl}- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CC1C(=O)N(C(=S)N1CCc1ccccc1)c1ccc(cc1)N(C)C

STK538833
Synonyms: (6aR,6bS,9aR,10S)- 8- (2- methoxy- 5- nitrophenyl)- 10- (phenylcarbonyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)c1ccccc1)[N+](=O)[O-]

STK538835
Synonyms: 8- (butylsulfanyl)- 2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CCCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C

STK538836
Synonyms: 2- {[(2E)- 3- chlorobut- 2- en- 1- yl]sulfanyl}- 6,6- dimethyl- 3- (3- methylphenyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: C/C(=C\CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)(C)C)/Cl

STK538837
Synonyms: (8S,8aR,11aS,11bS)- 8- [(4- bromophenyl)carbonyl]- 10- (4- fluorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccc(cc2)Br)C=Cc2c1cccc2

STK538838
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- {(E)- [2- hydroxy- 3- (prop- 2- en- 1- yl)phenyl]methylidene}acetohydrazide
Smiles: C=CCc1cccc(c1O)/C=N/NC(=O)Cn1nnc(n1)N

STK538839
Synonyms: N'- [(E)- (5- bromo- 2- hydroxyphenyl)methylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1cncn1)N/N=C/c1cc(Br)ccc1O

STK538840
Synonyms: 2- {[9- methyl- 5- (methylsulfanyl)- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}- 1- phenylethanone
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)c1ccccc1)nn2)CCN(C3)C

STK538841
Synonyms: 1,3- dimethyl- 8- [(2E)- 2- (3- nitrobenzylidene)hydrazinyl]- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(N/N=C/c2cccc(c2)[N+](=O)[O-])nc2c1c(=O)n(c(=O)n2C)C

STK538842
Synonyms: 2- hydroxy- 2- (4- nitrophenyl)ethylmorpholine- 4- carbodithioate
Smiles: OC(c1ccc(cc1)[N+](=O)[O-])CSC(=S)N1CCOCC1

STK538844
Synonyms: N'- [(1E)- 1- (4- methylphenyl)ethylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C(/c1ccc(cc1)C)\C

STK538845
Synonyms: 3- [3- acetyl- 4- hydroxy- 2- (2- nitrophenyl)- 5- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl]propanoicacid
Smiles: OC(=O)CCN1C(=O)C(=C(C1c1ccccc1[N+](=O)[O-])C(=O)C)O

STK538846
Synonyms: 2- [(4- {[(4- chlorophenyl)sulfanyl]methyl}- 6- hydroxypyrimidin- 2- yl)sulfanyl]- 1- (2,2,4,6,7- pentamethylquinolin- 1(2H)- yl)ethanone
Smiles: Oc1nc(SCC(=O)N2c3cc(C)c(cc3C(=CC2(C)C)C)C)nc(c1)CSc1ccc(cc1)Cl

STK538847
Synonyms: 2- chloro- N'- (1- methyl- 1H- pyrazolo[3,4- d]pyrimidin- 4- yl)benzohydrazide
Smiles: O=C(c1ccccc1Cl)NNc1ncnc2c1cnn2C

STK538848
Synonyms: 8- {(2Z)- 2- [1- (4- hydroxyphenyl)ethylidene]hydrazinyl}- 1,3- dimethyl- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(N/N=C(\c2ccc(cc2)O)/C)nc2c1c(=O)n(c(=O)n2C)C

STK538849
Synonyms: 3- {[(E)- (2- fluorophenyl)methylidene]amino}- 7,8- dimethoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1cc2c(cc1OC)[nH]c1c2[nH]c(=O)n(c1=O)/N=C/c1ccccc1F

STK538850
Synonyms: 2- {[(thiophen- 2- ylacetyl)carbamothioyl]amino}- 4,5,6,7,8,9- hexahydrocycloocta[b]thiophene- 3- carboxamide
Smiles: O=C(NC(=S)Nc1sc2c(c1C(=O)N)CCCCCC2)Cc1cccs1

STK538852
Synonyms: 7- (2- chlorobenzyl)- 1,3- dimethyl- 8- [(2E)- 2- (4- methylbenzylidene)hydrazinyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C

STK538853
Synonyms: 9- bromo- 2- [4- (prop- 2- en- 1- yloxy)phenyl]- 5- (thiophen- 2- yl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: C=CCOc1ccc(cc1)C1=NN2C(C1)c1cc(Br)ccc1OC2c1cccs1

STK538854
Synonyms: 1- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 4- (3- methylphenyl)- 6,7,8,9- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CCCC3

STK538856
Synonyms: ethyl[(4- bromophenyl)(hydroxy)methyl](phenylethynyl)phosphinate
Smiles: CCOP(=O)(C(c1ccc(cc1)Br)O)C#Cc1ccccc1

STK538858
Synonyms: (8E)- 2- amino- 6- benzyl- 8- (4- ethoxybenzylidene)- 4- (4- ethoxyphenyl)- 5,6,7,8- tetrahydro- 4H- pyrano[3,2- c]pyridine- 3- carbonitrile
Smiles: CCOc1ccc(cc1)/C=C/1\CN(Cc2ccccc2)CC2=C1OC(=C(C2c1ccc(cc1)OCC)C#N)N

STK538859
Synonyms: 8- (3- methylphenyl)- 9- (propylsulfanyl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CCCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCc1c3cccc1

STK538861
Synonyms: 2- hydrazinyl- 3- (3- methylphenyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: NNc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCCC3

STK538862
Synonyms: ethyl3- {[ethoxy(oxo)acetyl]amino}- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)C(=O)Nc1c([nH]c2c1cc(F)cc2)C(=O)OCC

STK538863
Synonyms: 1- amino- 8,8- dimethyl- 5- (morpholin- 4- yl)- N,N- diphenyl- 8,9- dihydro- 6H- pyrano[4,3- d]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCOCC1)N(c1ccccc1)c1ccccc1

STK538864
Synonyms: {[3- cyano- 4- phenyl- 6- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}(phenyl)aceticacid
Smiles: N#Cc1c(SC(c2ccccc2)C(=O)O)nc(cc1c1ccccc1)c1cccs1

STK538865
Synonyms: 4- bromo- N- [1- (phenylcarbonyl)- 1,2,3,4- tetrahydroquinolin- 6- yl]benzamide
Smiles: Brc1ccc(cc1)C(=O)Nc1ccc2c(c1)CCCN2C(=O)c1ccccc1

STK538866
Synonyms: 3- {[(E)- (3'- nitro- 2,2'- bithiophen- 5- yl)methylidene]amino}benzoicacid
Smiles: [O-][N+](=O)c1ccsc1c1ccc(s1)/C=N/c1cccc(c1)C(=O)O

STK538868
Synonyms: (1'R,3R,3'R)- 1'- [(4- bromophenyl)carbonyl]- 3'- [(3- nitrophenyl)carbonyl]- 3',3a'- dihydrospiro[indole- 3,2'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccc(c1)[N+](=O)[O-]

STK538869
Synonyms: N'- [(E)- (3- bromo- 4- hydroxy- 5- methoxyphenyl)methylidene]- 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2C)c2ccc(cc2)Cl)cc(c1O)Br

STK538870
Synonyms: 2- [(2- oxo- 2- phenylethyl)sulfanyl]- 3- phenyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: O=C(c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCC3

STK538871
Synonyms: 7- (2- hydroxy- 3- phenoxypropyl)- 3- methyl- 8- [(2- phenylethyl)amino]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(NCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C)COc1ccccc1

STK538872
Synonyms: (8R,8aR,11aS,11bS)- 8- acetyl- 10- (3- chlorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Clc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@H]2C(=O)C)C=Cc2c1cccc2

STK538873
Synonyms: 2,6- diaminopyridine- 3,4,5- tricarbonitrile
Smiles: N#Cc1c(C#N)c(N)nc(c1C#N)N

STK538874
Synonyms: (6aR,6bS,9aR,10S)- 10- [(4- bromophenyl)carbonyl]- 2- chloro- 8- (3,5- dichlorophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1[C@H]2[C@@H]([C@@H]3N1c1cc(Cl)ccc1C=C3)C(=O)N(C2=O)c1cc(Cl)cc(c1)Cl

STK538875
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- (2- ethylpiperidin- 1- yl)ethanone
Smiles: CCC1CCCCN1CC(=O)c1c(C)[nH]c2c1ccc(c2)C

STK538876
Synonyms: methyl2- ({[2- amino- 1- (3,5- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl]carbonyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK538877
Synonyms: 7,9- dichloro- 2- (3,4- dimethoxyphenyl)- 5- (4- ethoxyphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: CCOc1ccc(cc1)C1Oc2c(Cl)cc(cc2C2N1N=C(C2)c1ccc(c(c1)OC)OC)Cl

STK538878
Synonyms: 8- (benzylsulfanyl)- 1,3- dimethyl- 7- pentyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCn1c(SCc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK538879
Synonyms: 8- chloro- 3- ({(E)- [4- (prop- 2- en- 1- yloxy)phenyl]methylidene}amino)- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: C=CCOc1ccc(cc1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)Cl

STK538881
Synonyms: N'- [(1E)- 1- (4- methoxyphenyl)ethylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: COc1ccc(cc1)/C(=N/NC(=O)CSc1ccccn1)/C

STK538885
Synonyms: ethyl2- ({[(2,4- dichlorophenyl)carbonyl]carbamothioyl}amino)- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2ccc(cc2Cl)Cl)sc2c1CCCCC2

STK538886
Synonyms: 3- amino- N- (2- chlorobenzyl)- 6- (3- methoxyphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)NCc1ccccc1Cl

STK538889
Synonyms: 8- [(2E)- 2- (4- fluorobenzylidene)hydrazinyl]- 3- methyl- 7- (2- methylpropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(Cn1c(N/N=C/c2ccc(cc2)F)nc2c1c(=O)[nH]c(=O)n2C)C

STK538890
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 3- phenyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Clc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCCC3

STK538891
Synonyms: 2- [(2E)- 2- (4- chlorobenzylidene)hydrazinyl]- 4,6- dimethylpyrimidine
Smiles: Clc1ccc(cc1)/C=N/Nc1nc(C)cc(n1)C

STK538892
Synonyms: 4- hydroxy- 1- methyl- 2- oxo- N- [2- (piperazin- 1- yl)ethyl]- 1,2- dihydroquinoline- 3- carboxamide
Smiles: O=C(c1c(O)c2ccccc2n(c1=O)C)NCCN1CCNCC1

STK538893
Synonyms: 8- [benzyl(methyl)amino]- 3- methyl- 7- octyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N(Cc1ccccc1)C

STK538894
Synonyms: 1- ethyl- 4- hydroxy- 2- oxo- N- [2- (piperazin- 1- yl)ethyl]- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCn1c(=O)c(C(=O)NCCN2CCNCC2)c(c2c1cccc2)O

STK538895
Synonyms: (5Z)- 1- [4- (propan- 2- yl)phenyl]- 5- (2,3,6,7- tetrahydro- 1H,5H- pyrido[3,2,1- ij]quinolin- 9- ylmethylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)/C(=C/c2cc3CCCN4c3c(c2)CCC4)/C(=O)N1c1ccc(cc1)C(C)C

STK538898
Synonyms: (9E)- 9- (4- fluorobenzylidene)- 5- (4- fluorophenyl)- 7- methyl- 3- (3- nitrophenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: CC1C/C(=C\c2ccc(cc2)F)/C2=C(C1)C(c1ccc(cc1)F)n1c(=N2)scc1c1cccc(c1)[N+](=O)[O-]

STK538901
Synonyms: N'- [(E)- (2- hydroxyphenyl)methylidene]- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1ccccc1O

STK538902
Synonyms: 5- (methylsulfanyl)- 10- (propan- 2- yl)- 3- (propylsulfanyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCCSc1nnc2n1c(SC)nc1c2c2CC(OCc2s1)C(C)C

STK538903
Synonyms: 3- {[(E)- (3- bromophenyl)methylidene]amino}- 2- propylquinazolin- 4(3H)- one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1cccc(c1)Br

STK538905
Synonyms: (8S,8aR,11aS,11bS)- 8- acetyl- 10- (naphthalen- 1- yl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: CC(=O)[C@@H]1[C@H]2[C@@H]([C@@H]3N1C=Cc1c3cccc1)C(=O)N(C2=O)c1cccc2c1cccc2

STK538906
Synonyms: methyl2- ({[2- amino- 1- (2- methoxyethyl)- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl]carbonyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COCCn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2

STK538907
Synonyms: 2- [(6- amino- 3,5- dicyano- 4- phenylpyridin- 2- yl)sulfanyl]- N- (4- fluorophenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2)F)nc(c(c1c1ccccc1)C#N)N

STK538908
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (2- hydroxy- 5- nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1cc(ccc1O)[N+](=O)[O-]

STK538909
Synonyms: 7- [2- hydroxy- 3- (4- methoxyphenoxy)propyl]- 1,3- dimethyl- 8- (piperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1ccc(cc1)OCC(Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCNCC1)O

STK538910
Synonyms: pentyl{[7- benzyl- 3- (4- methylphenyl)- 4- oxo- 3,4,5,6,7,8- hexahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}acetate
Smiles: CCCCCOC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCN(C3)Cc1ccccc1

STK538911
Synonyms: methyl2- ({[(3,4- dimethoxyphenyl)carbonyl]carbamothioyl}amino)- 4,5,6,7,8,9,10,11,12,13- decahydrocyclododeca[b]thiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC(=S)NC(=O)c2ccc(c(c2)OC)OC)sc2c1CCCCCCCCCC2

STK538912
Synonyms: ethyl6'- amino- 5'- cyano- 3'- {[(4- methylphenyl)sulfanyl]methyl}- 1H,2'H- spiro[piperidine- 4,4'- pyrano[2,3- c]pyrazole]- 1- carboxylate
Smiles: CCOC(=O)N1CCC2(CC1)C(=C(N)Oc1c2c(CSc2ccc(cc2)C)[nH]n1)C#N

STK538913
Synonyms: N'- (1- benzyl- 1H- pyrazolo[3,4- d]pyrimidin- 4- yl)- 4- methylbenzohydrazide
Smiles: Cc1ccc(cc1)C(=O)NNc1ncnc2c1cnn2Cc1ccccc1

STK538914
Synonyms: (8Z)- 2- amino- 8- (3- fluorobenzylidene)- 4- (3- fluorophenyl)- 6- propyl- 5,6,7,8- tetrahydro- 4H- pyrano[3,2- c]pyridine- 3- carbonitrile
Smiles: CCCN1C/C(=C/c2cccc(c2)F)/C2=C(C1)C(c1cccc(c1)F)C(=C(O2)N)C#N

STK538917
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1Z)- 1- phenylethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C(\c1ccccc1)/C

STK538918
Synonyms: ethyl(2- chloro- 1- hydroxy- 1- phenylethyl)(3,3- dimethylbut- 1- yn- 1- yl)phosphinate
Smiles: ClCC(P(=O)(C#CC(C)(C)C)OCC)(c1ccccc1)O

STK538919
Synonyms: 2- ({2- [2- (2,6- dimethyl- 1H- indol- 3- yl)- 2- oxoethyl]- 1,2,3,4- tetrahydroisoquinolin- 1- yl}methyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: Cc1ccc2c(c1)[nH]c(c2C(=O)CN1CCc2c(C1CN1C(=O)c3c(C1=O)cccc3)cccc2)C

STK538920
Synonyms: ethyl4- ({4- [(hexyloxy)carbonyl]phenyl}amino)- 8- methylquinoline- 3- carboxylate
Smiles: CCCCCCOC(=O)c1ccc(cc1)Nc1c(cnc2c1cccc2C)C(=O)OCC

STK538922
Synonyms: 2- [(1,3- benzodioxol- 5- ylmethyl)sulfanyl]- 3- (3- bromophenyl)- 6,6- dimethyl- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Brc1cccc(c1)n1c(SCc2ccc3c(c2)OCO3)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK538923
Synonyms: dipropan- 2- yl5- [({[3- (2,6- dichlorophenyl)- 5- methyl- 1,2- oxazol- 4- yl]carbonyl}carbamothioyl)amino]- 3- methylthiophene- 2,4- dicarboxylate
Smiles: CC(OC(=O)c1c(NC(=S)NC(=O)c2c(C)onc2c2c(Cl)cccc2Cl)sc(c1C)C(=O)OC(C)C)C

STK538925
Synonyms: (5E)- 5- [4- (diethylamino)benzylidene]- 2- [4- (2- methylphenyl)piperazin- 1- yl]- 1,3- thiazol- 4(5H)- one
Smiles: CCN(c1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccccc1C)CC

STK538926
Synonyms: (2E)- 3- (4- nitrophenyl)- N- [1- (phenylcarbonyl)- 1,2,3,4- tetrahydroquinolin- 6- yl]prop- 2- enamide
Smiles: O=C(Nc1ccc2c(c1)CCCN2C(=O)c1ccccc1)/C=C/c1ccc(cc1)[N+](=O)[O-]

STK538927
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1E)- 1- (4- methoxyphenyl)ethylidene]acetohydrazide
Smiles: COc1ccc(cc1)/C(=N/NC(=O)CSc1nnc(n1C)c1cccc(c1)Br)/C

STK538930
Synonyms: (8Z,8'Z)- 8,8'- bis{[(4'- amino- 3,3'- dimethylbiphenyl- 4- yl)amino]methylidene}- 1,1',6,6'- tetrahydroxy- 3,3'- dimethyl- 5,5'- di(propan- 2- yl)- 2,2'- binaphthalene- 7,7'(8H,8'H)- dione
Smiles: CC(C1=C(O)C(=O)/C(=C\Nc2ccc(cc2C)c2ccc(c(c2)C)N)/c2c1cc(C)c(c2O)c1c(C)cc2c(c1O)/C(=C/Nc1ccc(cc1C)c1ccc(c(c1)C)N)/C(=O)C(=C2C(C)C)O)C

STK538932
Synonyms: (5E)- 5- (2- ethoxybenzylidene)- 2- [4- (2- methylphenyl)piperazin- 1- yl]- 1,3- thiazol- 4(5H)- one
Smiles: CCOc1ccccc1/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccccc1C

STK538933
Synonyms: 1- (benzylsulfanyl)- 4- (3- methylphenyl)- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CC(C1OCc2c(C1)c1c(s2)n2c(SCc3ccccc3)nnc2n(c1=O)c1cccc(c1)C)C

STK538934
Synonyms: methyl5- chloro- 3- {[2- (4- ethylpiperazin- 1- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCN1CCN(CC1)C(C(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC)C

STK538936
Synonyms: 2- {[5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl]sulfanyl}- N- (2- nitrophenyl)acetamide
Smiles: O=C(Nc1ccccc1[N+](=O)[O-])CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK538937
Synonyms: 2- (3- bromo- 2,6- dimethyl- 4- oxoquinolin- 1(4H)- yl)- N- (3- methylphenyl)acetamide
Smiles: Cc1cccc(c1)NC(=O)Cn1c(C)c(Br)c(=O)c2c1ccc(c2)C

STK538938
Synonyms: benzyl(8R,8aR)- 6- amino- 8- (4- bromothiophen- 2- yl)- 5,7,7- tricyano- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)C(=O)OCc1ccccc1)c1scc(c1)Br)(C#N)C#N

STK538939
Synonyms: 4- benzyl- 1- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CC(C1OCc2c(C1)c1c(s2)n2c(SCC(=O)c3ccc(cc3)Cl)nnc2n(c1=O)Cc1ccccc1)C

STK538940
Synonyms: 2- (2- bromophenyl)- 3- (2- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccccc1n1c(nc2c(c1=O)cccc2)c1ccccc1Br

STK538942
Synonyms: 7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 1,3- dimethyl- 8- (4- methylpiperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CN1CCN(CC1)c1nc2c(n1CC(COc1ccccc1C)O)c(=O)n(c(=O)n2C)C

STK538943
Synonyms: (8S,8aR,11aS,11bS)- 8- [(4- bromophenyl)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: Brc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1C)[N+](=O)[O-])cccc3

STK538944
Synonyms: (2E)- N- (2,4- dichlorophenyl)- 2- (2- fluorobenzylidene)hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1Cl)Cl)N/N=C/c1ccccc1F

STK538945
Synonyms: N'- [(E)- (3- methoxyphenyl)methylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: COc1cccc(c1)/C=N/NC(=O)CSc1ccccn1

STK538946
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(1E)- 1- (4- nitrophenyl)ethylidene]acetohydrazide
Smiles: O=C(Cn1nnnc1N)N/N=C(/c1ccc(cc1)[N+](=O)[O-])\C

STK538948
Synonyms: methyl3- ({[4- (5- chloro- 2- methylphenyl)piperazin- 1- yl]acetyl}amino)- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cc(Cl)ccc1C)cc(c(c2)OC)OC

STK538949
Synonyms: 6- amino- 4- (2,4- difluorophenyl)- 3- methyl- 1- (4- methylphenyl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1F)F)c(C)nn2c1ccc(cc1)C

STK538950
Synonyms: 1- (chloromethyl)- 3- ethyl- 3- methyl- 3,4- dihydroisoquinoline
Smiles: ClCC1=NC(C)(CC)Cc2c1cccc2

STK538951
Synonyms: ethyl(8S,8aR)- 6- amino- 5,7,7- tricyano- 8- (4- fluorophenyl)- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1ccc(cc1)F)C(C(=C2C#N)N)(C#N)C#N

STK538953
Synonyms: 8- (4- benzylpiperazin- 1- yl)- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1ccccc1

STK538955
Synonyms: (6aR,6bS,9aR,10S)- 8- (2- methyl- 4- nitrophenyl)- 10- (phenylcarbonyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Cc1cc(ccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)c1ccccc1)[N+](=O)[O-]

STK538956
Synonyms: (6aR,6bS,9aR,10S)- 10- [(4- bromophenyl)carbonyl]- 8- (2- methyl- 5- nitrophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Brc1ccc(cc1)C(=O)[C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1cc(ccc1C)[N+](=O)[O-])C=Cc1c2cccc1

STK538957
Synonyms: N'- [(E)- (4- hydroxy- 3- methoxyphenyl)methylidene]- 6- oxo- 1,6- dihydropyridazine- 3- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2ccc(=O)[nH]n2)ccc1O

STK538958
Synonyms: N'- [(E)- (1,3- dimethyl- 1H- pyrazol- 4- yl)methylidene]- 2- methylquinoline- 4- carbohydrazide
Smiles: Cc1nc2ccccc2c(c1)C(=O)N/N=C/c1cn(nc1C)C

STK538959
Synonyms: methyl5- bromo- 3- [(phenoxycarbonyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)Oc1ccccc1)cc(cc2)Br

STK538960
Synonyms: 9- (4- chlorophenyl)- 2,2- dimethyl- 5- (morpholin- 4- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8(9H)- one
Smiles: Clc1ccc(cc1)n1cnc2c(c1=O)sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK538961
Synonyms: 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N'- [(E)- (4- nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(N/N=C/c1ccc(cc1)[N+](=O)[O-])CSc1nnc(n1C)c1ccccc1

STK538962
Synonyms: (4- butylphenyl)(2,2,2',2',4,4'- hexamethyl- 1,2,3,4- tetrahydro- 4,6'- biquinolin- 1'(2'H)- yl)methanone
Smiles: CCCCc1ccc(cc1)C(=O)N1c2ccc(cc2C(=CC1(C)C)C)C1(C)CC(C)(C)Nc2c1cccc2

STK538963
Synonyms: N'- [(E)- (2,4- dihydroxyphenyl)methylidene]- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1ccc(cc1O)O

STK538964
Synonyms: 1,3- dimethyl- 7- propyl- 8- [(2E)- 2- (pyridin- 4- ylmethylidene)hydrazinyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(N/N=C/c2ccncc2)nc2c1c(=O)n(c(=O)n2C)C

STK538965
Synonyms: (9E)- 9- [4- (difluoromethoxy)benzylidene]- 5- [4- (difluoromethoxy)phenyl]- 3- (3- nitrophenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: FC(Oc1ccc(cc1)/C=C/1\CCCC2=C1N=c1scc(n1C2c1ccc(cc1)OC(F)F)c1cccc(c1)[N+](=O)[O-])F

STK538966
Synonyms: N- {[4- (carbamimidoylsulfamoyl)phenyl]carbamothioyl}- 3,4- dimethoxybenzamide
Smiles: COc1cc(ccc1OC)C(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)NC(=N)N

STK538968
Synonyms: 4- acetyl- 5- (2- fluorophenyl)- 3- hydroxy- 1- (4- methylphenyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Cc1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1F)C(=O)C)O

STK538970
Synonyms: 6- methyl- 2- oxo- 1,2- dihydropyridine- 3,4- dicarbonitrile
Smiles: Cc1cc(C#N)c(c(=O)[nH]1)C#N

STK538971
Synonyms: 5- (4- butoxyphenyl)- 7,9- dichloro- 2- (4- methoxyphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: CCCCOc1ccc(cc1)C1Oc2c(Cl)cc(cc2C2N1N=C(C2)c1ccc(cc1)OC)Cl

STK538972
Synonyms: 7,9- dichloro- 5- (4- ethoxyphenyl)- 2- (4- methoxyphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: CCOc1ccc(cc1)C1Oc2c(Cl)cc(cc2C2N1N=C(C2)c1ccc(cc1)OC)Cl

STK538975
Synonyms: 10- acetyl- 8- (4- methylphenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)C2C(C1=O)C(N1C2C=Cc2c1cccc2)C(=O)C

STK538976
Synonyms: ethyl2- ({2- methoxy- 5- [(Z)- (1- oxo- 3,4- dihydronaphthalen- 2(1H)- ylidene)methyl]benzyl}oxy)benzoate
Smiles: CCOC(=O)c1ccccc1OCc1cc(ccc1OC)/C=C\1/CCc2c(C1=O)cccc2

STK538979
Synonyms: (8R,8aR,11aS,11bS)- 8- acetyl- 10- (4- bromophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: CC(=O)[C@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1C=Cc1c2cccc1)c1ccc(cc1)Br

STK538980
Synonyms: 3- amino- N- (4- chlorophenyl)- 6- (3- methoxyphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1ccc(cc1)Cl

STK538981
Synonyms: 2- (4- methoxyphenyl)- N'- (1- phenyl- 1H- pyrazolo[3,4- d]pyrimidin- 4- yl)acetohydrazide
Smiles: COc1ccc(cc1)CC(=O)NNc1ncnc2c1cnn2c1ccccc1

STK538982
Synonyms: N- (4- methoxyphenyl)- 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)Nc2ccc(cc2)OC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK538983
Synonyms: 5- hydroxy- 11a- (piperidin- 1- yl)- 6b,7,8,9,10,11a- hexahydro- 11H- naphtho[2',1':4,5]furo[2,3- c]azepin- 11- one
Smiles: O=C1NCCCC2C1(Oc1c2cc(c2c1cccc2)O)N1CCCCC1

STK538984
Synonyms: ethyl(8S)- 6- amino- 5,7,7- tricyano- 8- (3- methoxy- 4- propoxyphenyl)- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCCOc1ccc(cc1OC)[C@@H]1C2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(=O)OCC

STK538985
Synonyms: (8R,8aS,11aR,11bR)- 8- [(4- bromophenyl)carbonyl]- 10- (4- methylphenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H]1N([C@H]2C(=O)c2ccc(cc2)Br)C=Cc2c1cccc2

STK538987
Synonyms: 5- cyano- 2- methyl- N- phenyl- 6- sulfanyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(S)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1)C

STK538989
Synonyms: 8- chloro- 3- {[(E)- (3- ethoxy- 4- hydroxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCOc1cc(ccc1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Cl

STK538990
Synonyms: (8S,8aR,11aS,11bS)- 8- acetyl- 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: CC(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1C=Cc1c2cccc1)c1cc(ccc1C)[N+](=O)[O-]

STK538991
Synonyms: methyl{[4- (4- methylphenyl)- 5- oxo- 7- (propan- 2- yl)- 4,5,6,9- tetrahydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CC(OC3)C(C)C

STK538992
Synonyms: 2- phenyl- N'- [(1E)- 1- phenylbutylidene]quinoline- 4- carbohydrazide
Smiles: CCC/C(=N\NC(=O)c1cc(nc2c1cccc2)c1ccccc1)/c1ccccc1

STK538993
Synonyms: (9E)- 3- (4- bromophenyl)- 9- [4- (difluoromethoxy)benzylidene]- 5- [4- (difluoromethoxy)phenyl]- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: FC(Oc1ccc(cc1)/C=C/1\CCCC2=C1N=c1scc(n1C2c1ccc(cc1)OC(F)F)c1ccc(cc1)Br)F

STK538995
Synonyms: (8S,8aR,11aS,11bS)- 8- acetyl- 10- phenyl- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: O=C1N(c2ccccc2)C(=O)[C@H]2[C@@H]1[C@@H](C(=O)C)N1[C@@H]2c2ccccc2C=C1

STK538996
Synonyms: tert- butyl{[3- cyano- 6- phenyl- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}acetate
Smiles: N#Cc1c(SCC(=O)OC(C)(C)C)nc(cc1c1cccs1)c1ccccc1

STK538997
Synonyms: ethyl6- amino- 4- (4- tert- butylphenyl)- 5- cyano- 2- phenyl- 4H- pyran- 3- carboxylate
Smiles: CCOC(=O)C1=C(OC(=C(C1c1ccc(cc1)C(C)(C)C)C#N)N)c1ccccc1

STK538998
Synonyms: N'- [(1Z)- 1- (4- methoxyphenyl)ethylidene]- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: COc1ccc(cc1)/C(=N\NC(=O)CSc1nnc(n1C)c1ccccc1)/C

STK538999
Synonyms: 4- [(E)- {2- [4- (4- methylphenyl)piperazin- 1- yl]- 4- oxo- 1,3- thiazol- 5(4H)- ylidene}methyl]phenylbenzenesulfonate
Smiles: Cc1ccc(cc1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(cc2)OS(=O)(=O)c2ccccc2)/S1

STK539000
Synonyms: 3- amino- N- (2,4- dibromophenyl)- 6- (thiophen- 2- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: Brc1ccc(c(c1)Br)NC(=O)c1sc2c(c1N)ccc(n2)c1cccs1

STK539001
Synonyms: 2- {2- methoxy- 4- [(E)- {2- [(2- methylquinolin- 4- yl)carbonyl]hydrazinylidene}methyl]phenoxy}acetamide
Smiles: COc1cc(/C=N/NC(=O)c2cc(C)nc3c2cccc3)ccc1OCC(=O)N

STK539002
Synonyms: 8- {[cyclohexyl(ethyl)amino]methyl}- 3- (3,4- dimethoxyphenyl)- 7- hydroxy- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CCN(C1CCCCC1)Cc1c(O)ccc2c1oc(c(c2=O)c1ccc(c(c1)OC)OC)C(F)(F)F

STK539003
Synonyms: propan- 2- yl{[3- cyano- 4- (4- fluorophenyl)- 6- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}acetate
Smiles: N#Cc1c(SCC(=O)OC(C)C)nc(cc1c1ccc(cc1)F)c1cccs1

STK539004
Synonyms: N'- [(E)- (2,4- dichlorophenyl)methylidene]- 2- [4- (1H- tetrazol- 1- yl)phenoxy]acetohydrazide
Smiles: O=C(COc1ccc(cc1)n1cnnn1)N/N=C/c1ccc(cc1Cl)Cl

STK539005
Synonyms: 2- methyl- 3- {[(1E)- 1- (pyridin- 4- yl)ethylidene]amino}quinazolin- 4(3H)- one
Smiles: C/C(=N\n1c(C)nc2c(c1=O)cccc2)/c1ccncc1

STK539006
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- {(E)- [4- (dimethylamino)phenyl]methylidene}acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1ccc(cc1)N(C)C

STK539007
Synonyms: 5- {(E)- [2- (4,6- dimethylpyrimidin- 2- yl)hydrazinylidene]methyl}- 2- ethoxyphenol
Smiles: CCOc1ccc(cc1O)/C=N/Nc1nc(C)cc(n1)C

STK539009
Synonyms: 8- {[2- (dimethylamino)ethyl]amino}- 1,3- dimethyl- 7- (4- methylbenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CN(CCNc1nc2c(n1Cc1ccc(cc1)C)c(=O)n(c(=O)n2C)C)C

STK539010
Synonyms: 1- (4- bromophenyl)- 2- [(8,8- dimethyl- 7,10- dihydro- 8H- pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 4- yl)oxy]ethanone
Smiles: Brc1ccc(cc1)C(=O)COc1ncnc2c1sc1c2cc2c(n1)CC(OC2)(C)C

STK539011
Synonyms: 6- amino- 8- (2- chloro- 6- fluorophenyl)- 2- propyl- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: CCCN1CC=C2C(C1)C(c1c(F)cccc1Cl)C(C(=C2C#N)N)(C#N)C#N

STK539015
Synonyms: 8- (diethylamino)- 7- ethenyl- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCN(c1nc2c(n1C=C)c(=O)[nH]c(=O)n2C)CC

STK539017
Synonyms: methyl3- [({1- [(1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)methyl]- 3,4- dihydroisoquinolin- 2(1H)- yl}acetyl)amino]- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1CN1C(=O)c4c(C1=O)cccc4)cccc3)cc(c(c2)OC)OC

STK539018
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- cyclohexylideneacetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)NN=C1CCCCC1

STK539021
Synonyms: 2,6,8- trimethyl- 3- [(3- methylpiperidin- 1- yl)methyl]quinolin- 4- ol
Smiles: CC1CCCN(C1)Cc1c(C)nc2c(c1O)cc(cc2C)C

STK539022
Synonyms: ethyl3,3,3- trifluoro- 2- (4- {[(3- fluorophenyl)carbonyl](methyl)amino}phenyl)- 2- hydroxypropanoate
Smiles: CCOC(=O)C(C(F)(F)F)(c1ccc(cc1)N(C(=O)c1cccc(c1)F)C)O

STK539023
Synonyms: (6aS,6bR,9aS,10R)- 10- [(4- bromophenyl)carbonyl]- 8- (2,4- dimethylphenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1C)C)C=Cc1c2cccc1

STK539024
Synonyms: (9E)- 3- (4- chlorophenyl)- 9- (4- fluorobenzylidene)- 5- (4- fluorophenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: Fc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Cl)/C(=C/c1ccc(cc1)F)/CCC2

STK539025
Synonyms: (4S,4aR)- 2- amino- 4- (3- ethoxy- 4- propoxyphenyl)- 4a,5,6,7- tetrahydronaphthalene- 1,3,3(4H)- tricarbonitrile
Smiles: CCCOc1ccc(cc1OCC)[C@@H]1[C@H]2CCCC=C2C(=C(C1(C#N)C#N)N)C#N

STK539026
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(1E)- 1- (4- nitrophenyl)ethylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C(/c1ccc(cc1)[N+](=O)[O-])\C

STK539027
Synonyms: 2- [4- (5- chloro- 2- methylphenyl)piperazin- 1- yl]- 1- (2,6- dimethyl- 1H- indol- 3- yl)ethanone
Smiles: Cc1ccc2c(c1)[nH]c(c2C(=O)CN1CCN(CC1)c1cc(Cl)ccc1C)C

STK539028
Synonyms: N'- [(E)- (2,4- dihydroxyphenyl)methylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1cncn1)N/N=C/c1ccc(cc1O)O

STK539029
Synonyms: dipropan- 2- yl{[4,5- dihydrofuran- 3- yl(diphenyl)- lambda~5~- phosphanylidene][(E)- (4- nitrophenyl)diazenyl]methyl}phosphonate
Smiles: CC(OP(=O)(C(=P(c1ccccc1)(c1ccccc1)C1=COCC1)/N=N/c1ccc(cc1)[N+](=O)[O-])OC(C)C)C

STK539030
Synonyms: 3- (4- methoxyphenyl)- 2- [(4- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK539033
Synonyms: N'- [(Z)- anthracen- 9- ylmethylidene]- 2- methylquinoline- 4- carbohydrazide
Smiles: Cc1nc2ccccc2c(c1)C(=O)N/N=C\c1c2ccccc2cc2c1cccc2

STK539034
Synonyms: 8- (4- benzylpiperazin- 1- yl)- 1,3- dimethyl- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCN(CC1)Cc1ccccc1

STK539035
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (6- methylpyridin- 2- yl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1cccc(n1)C

STK539037
Synonyms: (1'R,3R,3'R)- 3'- (1,3- benzodioxol- 5- ylcarbonyl)- 1'- [(4- bromophenyl)carbonyl]- 7'- chloro- 3',3a'- dihydrospiro[indole- 3,2'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccc2c(c1)OCO2)Cl

STK539038
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- (2- methylpiperidin- 1- yl)ethanone
Smiles: Cc1ccc2c(c1)[nH]c(c2C(=O)CN1CCCCC1C)C

STK539039
Synonyms: (6aR,6bS,9aR,10S)- 10- acetyl- 8- (4- nitrophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: O=C1N(c2ccc(cc2)[N+](=O)[O-])C(=O)[C@@H]2[C@H]1[C@H]1C=Cc3c(N1[C@@H]2C(=O)C)cccc3

STK539040
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (2- fluorophenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1ccccc1F

STK539041
Synonyms: 6- amino- 4- (4- fluorophenyl)- 3- methyl- 1- (4- methylphenyl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)F)c(C)nn2c1ccc(cc1)C

STK539042
Synonyms: 11- (3,4- dichlorophenyl)- 2- ethyl- 3- (furan- 2- ylmethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCc1nc2n(c3ccc(c(c3)Cl)Cl)c3c(c2c(=O)n1Cc1ccco1)nc1c(n3)cccc1

STK539043
Synonyms: 1- [2- (diethylamino)ethyl]- 3- hydroxy- 5- (4- nitrophenyl)- 4- [(2E)- 3- phenylprop- 2- enoyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: CCN(CCN1C(=O)C(=C(C1c1ccc(cc1)[N+](=O)[O-])C(=O)/C=C/c1ccccc1)O)CC

STK539044
Synonyms: 2- (1H- benzimidazol- 2- yl)- N'- [(E)- pyridin- 3- ylmethylidene]acetohydrazide
Smiles: O=C(Cc1nc2c([nH]1)cccc2)N/N=C/c1cccnc1

STK539045
Synonyms: 3- cyclohexyl- 2- [(4- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Cc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1C1CCCCC1)CCCCC3

STK539046
Synonyms: ethyl4- hydroxy- 2- (4- nitrophenyl)- 5- oxo- 1- phenyl- 2,5- dihydro- 1H- pyrrole- 3- carboxylate
Smiles: CCOC(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK539048
Synonyms: 3- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 5- (methylsulfanyl)- 10- (propan- 2- yl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=C)C)nn2)CC(OC3)C(C)C

STK539049
Synonyms: N,N- dicyclohexyl- 1,1,1,3,3,4,4,6,6,7,7,9,9,10,10,12,12- heptadecafluoro- 2,5,8,11- tetraoxatridecan- 13- amide
Smiles: O=C(C(OC(C(OC(C(OC(C(OC(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)N(C1CCCCC1)C1CCCCC1

STK539050
Synonyms: 3- (3- chlorophenyl)- 4- phenyl- 5- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 4H- 1,2,4- triazole
Smiles: Clc1cccc(c1)c1nnc(n1c1ccccc1)SC/C=C/c1ccccc1

STK539051
Synonyms: 9- chloro- 2- (4- ethoxyphenyl)- 5- [4- (propan- 2- yloxy)phenyl]- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: CCOc1ccc(cc1)C1=NN2C(C1)c1cc(Cl)ccc1OC2c1ccc(cc1)OC(C)C

STK539052
Synonyms: 11- (3- methoxyphenyl)- 2- methyl- 3- (1- phenylethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1cccc(c1)n1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)C(c1ccccc1)C

STK539054
Synonyms: 6- amino- 4- (3,4- difluorophenyl)- 3- methyl- 1- (4- methylphenyl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(c(c1)F)F)c(C)nn2c1ccc(cc1)C

STK539055
Synonyms: 11- (4- butylphenyl)- 3- (2- methoxyethyl)- 2- methyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)CCOC

STK539056
Synonyms: 7- [(2Z)- 3- chlorobut- 2- en- 1- yl]- 8- (hexylamino)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCNc1nc2c(n1C/C=C(\Cl)/C)c(=O)[nH]c(=O)n2C

STK539057
Synonyms: N'- [(1E)- 1- phenylethylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(N/N=C(/c1ccccc1)\C)CSc1ccccn1

STK539058
Synonyms: 3- amino- 6- (3- methoxyphenyl)- N- (2,2,2- trifluoroethyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)NCC(F)(F)F

STK539059
Synonyms: 2- chloro- N'- [1- (4- methylphenyl)- 1H- pyrazolo[3,4- d]pyrimidin- 4- yl]benzohydrazide
Smiles: Cc1ccc(cc1)n1ncc2c1ncnc2NNC(=O)c1ccccc1Cl

STK539060
Synonyms: N- (4- methylphenyl)- 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)Nc2ccc(cc2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK539061
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (3- bromophenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1cccc(c1)Br

STK539063
Synonyms: N'- {(E)- [4- (propan- 2- yl)phenyl]methylidene}- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/c1ccc(cc1)C(C)C

STK539064
Synonyms: ethyl2- ({(2E)- 2- cyano- 3- [5- (3- nitrophenyl)furan- 2- yl]prop- 2- enoyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C(=C/c2ccc(o2)c2cccc(c2)[N+](=O)[O-])/C#N)sc2c1CCCC2

STK539066
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 3- (2- methoxyphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: COc1ccccc1n1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK539067
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (4- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1C)c1ccc(cc1)Cl

STK539068
Synonyms: 2- (1H- benzimidazol- 2- yl)- 3- hydroxy- 2- (4- methoxybenzyl)propanenitrile
Smiles: COc1ccc(cc1)CC(c1nc2c([nH]1)cccc2)(C#N)CO

STK539069
Synonyms: (2E)- N- (2,4- dichlorophenyl)- 2- [1- (2,4- dimethoxyphenyl)ethylidene]hydrazinecarbothioamide
Smiles: COc1cc(OC)ccc1/C(=N/NC(=S)Nc1ccc(cc1Cl)Cl)/C

STK539070
Synonyms: 3- methyl- 7- (3- phenylpropyl)- 8- (propylamino)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCNc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C

STK539071
Synonyms: {[6,6- dimethyl- 3- (3- methylphenyl)- 4- oxo- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}aceticacid
Smiles: OC(=O)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)(C)C

STK539072
Synonyms: 3- amino- N- [4- chloro- 3- (trifluoromethyl)phenyl]- 6- (3- methoxyphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1ccc(c(c1)C(F)(F)F)Cl

STK539073
Synonyms: N'- [(E)- (2- hydroxy- 3- methoxyphenyl)methylidene]- 6- oxo- 1,6- dihydropyridazine- 3- carbohydrazide
Smiles: COc1cccc(c1O)/C=N/NC(=O)c1ccc(=O)[nH]n1

STK539074
Synonyms: N- (1H- benzimidazol- 2- yl)- 1- butyl- 4- hydroxy- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCCCn1c(=O)c(C(=O)Nc2nc3c([nH]2)cccc3)c(c2c1cccc2)O

STK539075
Synonyms: 2,7- bis(piperidin- 1- ylmethyl)- 1,8- bis(4- propoxyphenyl)octane- 1,8- dione
Smiles: CCCOc1ccc(cc1)C(=O)C(CN1CCCCC1)CCCCC(C(=O)c1ccc(cc1)OCCC)CN1CCCCC1

STK539076
Synonyms: ethyl3- {[(4- chlorophenyl)carbonyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)c1ccc(cc1)Cl)cc(cc2)OC

STK539078
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (3,4- dimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2C)c2cccc(c2)Br)ccc1OC

STK539079
Synonyms: 7- ethyl- 1,3- dimethyl- 8- [(2E)- 2- (4- nitrobenzylidene)hydrazinyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc2c1c(=O)n(c(=O)n2C)C

STK539081
Synonyms: N'- {(E)- [4- (diethylamino)phenyl]methylidene}- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: CCN(c1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1C)c1ccccc1)CC

STK539082
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1E)- 1- phenylethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C(/c1ccccc1)\C

STK539083
Synonyms: 3- (prop- 2- en- 1- ylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: C=CCSc1nnc2n1cnc1c2c2CCCCc2s1

STK539084
Synonyms: 4- fluoro- N- {3- [(4- methylphenyl)sulfonyl]- 1- octyl- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}benzenesulfonamide
Smiles: CCCCCCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)F)S(=O)(=O)c1ccc(cc1)C

STK539085
Synonyms: (1'R,3R,3'R)- 1'- [(3,4- dimethoxyphenyl)carbonyl]- 3'- [(4- methoxyphenyl)carbonyl]- 3',3a'- dihydrospiro[indole- 3,2'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: COc1ccc(cc1)C(=O)[C@H]1C2C=Cc3c(N2[C@H]([C@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(c(c1)OC)OC)cccc3

STK539086
Synonyms: 2- {[1,1,1,3,3,3- hexafluoro- 2- (furan- 2- ylamino)propan- 2- yl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: N#Cc1c(sc2c1CCCC2)NC(C(F)(F)F)(C(F)(F)F)Nc1ccco1

STK539088
Synonyms: 4- (3- methylphenyl)- 1- {[1- (morpholin- 4- yl)- 1- oxopropan- 2- yl]sulfanyl}- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CC(C1OCc2c(C1)c1c(s2)n2c(nnc2n(c1=O)c1cccc(c1)C)SC(C(=O)N1CCOCC1)C)C

STK539089
Synonyms: 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N'- [(E)- phenylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1ccccc1

STK539090
Synonyms: 2- amino- 4- (3,4- difluorophenyl)- 6- hexyl- 7- hydroxy- 4H- chromene- 3- carbonitrile
Smiles: CCCCCCc1cc2c(cc1O)OC(=C(C2c1ccc(c(c1)F)F)C#N)N

STK539091
Synonyms: 8- [(2E)- 2- benzylidenehydrazinyl]- 7- (4- fluorobenzyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccc(cc1)Cn1c(N/N=C/c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK539097
Synonyms: 6- {[3- (dimethylamino)propyl]amino}- 3,3- dimethyl- 8- (2- methylpropyl)- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: N#Cc1c(NCCCN(C)C)nc(c2c1CC(C)(C)OC2)CC(C)C

STK539098
Synonyms: 4- benzyl- 1- (hexylsulfanyl)- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CC(OC3)C(C)C

STK539099
Synonyms: (2E)- 2- (5- bromo- 2,4- dimethoxybenzylidene)- N- (2,4- dichlorophenyl)hydrazinecarbothioamide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=S)Nc1ccc(cc1Cl)Cl)Br

STK539100
Synonyms: 7- benzyl- 8- [(2E)- 2- (2- hydroxy- 3- methoxybenzylidene)hydrazinyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1cccc(c1O)/C=N/Nc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

STK539101
Synonyms: 11- (2- methylpropyl)- 7,8,9,10- tetrahydrotetrazolo[1'',5'':1',6']pyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: CC(Cc1nc2sc3c(c2c2c1CCCC2)ncn1c3nnn1)C

STK539102
Synonyms: N'- [(1Z)- 1- (4- bromophenyl)ethylidene]- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C(\c1ccc(cc1)Br)/C

STK539103
Synonyms: 4- [(E)- {2- [(1,3- benzothiazol- 2- ylsulfanyl)acetyl]hydrazinylidene}methyl]- 2- methoxyphenyl(2,4- dioxo- 1,3- thiazolidin- 5- yl)acetate
Smiles: COc1cc(/C=N/NC(=O)CSc2nc3c(s2)cccc3)ccc1OC(=O)CC1SC(=O)NC1=O

STK539105
Synonyms: 3- amino- N- (3- chlorophenyl)- 6- (3- methoxyphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1cccc(c1)Cl

STK539106
Synonyms: N,N- dibutyl- 2- {[5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1)CCCC

STK539107
Synonyms: 8- (cyclohexylmethyl)- 9- (heptylsulfanyl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1CC1CCCCC1)CCc1c3cccc1

STK539108
Synonyms: 3- (2- methylpropyl)- 5- (trifluoromethyl)- 4,5- dihydro- 1,2- oxazol- 5- ol
Smiles: CC(CC1=NOC(C1)(O)C(F)(F)F)C

STK539110
Synonyms: N'- [(1E)- 1- (4- methylphenyl)ethylidene]- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C(/c1ccc(cc1)C)\C

STK539112
Synonyms: (3aR,4S,9aR,9bS)- 4- [(4- bromophenyl)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)Br)C=CC(=C1)C(=O)c1ccccc1

STK539115
Synonyms: 7- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- N- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)heptanamide
Smiles: O=C(NC12CC3CC(C2)CC(C1)C3)CCCCCCN1C(=O)c2c(C1=O)cccc2

STK539116
Synonyms: 3- (3- methylphenyl)- 2- [(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)c1cccc(c1)C)SCCc1ccccc1)C

STK539117
Synonyms: 8- (benzylsulfanyl)- 2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: Cc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCc1ccccc1

STK539118
Synonyms: 3,4- dimethoxy- N- {[4- (1,3- thiazol- 2- ylsulfamoyl)phenyl]carbamothioyl}benzamide
Smiles: COc1cc(ccc1OC)C(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1

STK539119
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1Z)- 1- (4- methylphenyl)ethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C(\c1ccc(cc1)C)/C

STK539120
Synonyms: N'- [(E)- (4- methylphenyl)methylidene]- 2- phenylquinoline- 4- carbohydrazide
Smiles: Cc1ccc(cc1)/C=N/NC(=O)c1cc(nc2c1cccc2)c1ccccc1

STK539121
Synonyms: 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N'- [(1E)- 1- phenylpropylidene]acetohydrazide
Smiles: CC/C(=N\NC(=O)CSc1nnc(n1C)c1ccccc1)/c1ccccc1

STK539122
Synonyms: (3- ethoxy- 3- oxopropyl)[hydroxy(phenyl)methyl]phosphinicacid
Smiles: CCOC(=O)CCP(=O)(C(c1ccccc1)O)O

STK539125
Synonyms: 2- [(Z)- (1- benzyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)methyl]- 6- iodo- 3- phenylquinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C\1/c2ccccc2N(C1=O)Cc1ccccc1)c1ccccc1

STK539127
Synonyms: 2- cyclopropyl- N'- [(E)- (3- phenoxyphenyl)methylidene]quinoline- 4- carbohydrazide
Smiles: O=C(c1cc(nc2c1cccc2)C1CC1)N/N=C/c1cccc(c1)Oc1ccccc1

STK539128
Synonyms: 1- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 4- (3- methylphenyl)- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Brc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CCC3

STK539129
Synonyms: (8Z,8'Z)- 1,1',6,6'- tetrahydroxy- 3,3'- dimethyl- 8,8'- bis[({4- [(E)- phenyldiazenyl]phenyl}amino)methylidene]- 5,5'- di(propan- 2- yl)- 2,2'- binaphthalene- 7,7'(8H,8'H)- dione
Smiles: CC(C1=C(O)C(=O)/C(=C\Nc2ccc(cc2)/N=N/c2ccccc2)/c2c1cc(C)c(c2O)c1c(C)cc2c(c1O)/C(=C/Nc1ccc(cc1)/N=N/c1ccccc1)/C(=O)C(=C2C(C)C)O)C

STK539131
Synonyms: 2- [(4,5- diphenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N'- [(E)- (2- hydroxy- 3- methoxy- 5- nitrophenyl)methylidene]acetohydrazide
Smiles: COc1cc(cc(c1O)/C=N/NC(=O)CSc1nnc(n1c1ccccc1)c1ccccc1)[N+](=O)[O-]

STK539132
Synonyms: N- [4- chloro- 2- (phenylcarbonyl)phenyl]- 2,2,3,3,4,4,4- heptafluorobutanamide
Smiles: Clc1ccc(c(c1)C(=O)c1ccccc1)NC(=O)C(C(C(F)(F)F)(F)F)(F)F

STK539133
Synonyms: 3- {[(E)- (4- ethoxyphenyl)methylidene]amino}- 2- (phenoxymethyl)quinazolin- 4(3H)- one
Smiles: CCOc1ccc(cc1)/C=N/n1c(COc2ccccc2)nc2c(c1=O)cccc2

STK539134
Synonyms: methyl3- {[(3- methylphenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1cccc(c1)C)cccc2

STK539135
Synonyms: 9- methyl- 3,5- bis(methylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SC)nn2)CCC(C3)C

STK539136
Synonyms: ethyl5- methoxy- 3- {[(3- methoxyphenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)c1cccc(c1)OC)cc(cc2)OC

STK539138
Synonyms: 3- amino- 6- methyl- N- (propan- 2- yl)- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b][1,6]naphthyridine- 2- carboxamide
Smiles: CN1CCc2c(C1)c(c1cccs1)c1c(n2)sc(c1N)C(=O)NC(C)C

STK539139
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- phenylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1ccccc1

STK539140
Synonyms: 2- (3,4- dimethoxyphenyl)- 9- nitro- 5- [4- (propan- 2- yl)phenyl]- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: COc1ccc(cc1OC)C1=NN2C(C1)c1cc(ccc1OC2c1ccc(cc1)C(C)C)[N+](=O)[O-]

STK539141
Synonyms: (5E)- 5- (2- butoxybenzylidene)- 2- [4- (3- chloro- 4- methylphenyl)piperazin- 1- yl]- 1,3- thiazol- 4(5H)- one
Smiles: CCCCOc1ccccc1/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccc(c(c1)Cl)C

STK539143
Synonyms: N- (2- methylphenyl)- 2- [(4- oxo- 3- phenyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCCC3

STK539146
Synonyms: 4- [(E)- {2- [4- (3- methylphenyl)piperazin- 1- yl]- 4- oxo- 1,3- thiazol- 5(4H)- ylidene}methyl]phenylbenzenesulfonate
Smiles: Cc1cccc(c1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(cc2)OS(=O)(=O)c2ccccc2)/S1

STK539147
Synonyms: 3- {[(E)- (6- bromo- 2- hydroxynaphthalen- 1- yl)methylidene]amino}- 2- methylquinazolin- 4(3H)- one
Smiles: Brc1ccc2c(c1)ccc(c2/C=N/n1c(C)nc2c(c1=O)cccc2)O

STK539149
Synonyms: 2- [7- (4- benzylpiperazin- 1- yl)- 7- oxoheptyl]- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C(N1CCN(CC1)Cc1ccccc1)CCCCCCN1C(=O)c2c(C1=O)cccc2

STK539150
Synonyms: 2- {[3- cyano- 6- phenyl- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (3,4- dimethoxyphenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(c(c2)OC)OC)nc(cc1c1cccs1)c1ccccc1

STK539151
Synonyms: 3- (3- methylphenyl)- 6- (propan- 2- yl)- 2- (prop- 2- en- 1- ylsulfanyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: C=CCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C

STK539152
Synonyms: 2- amino- N- (3,4- dimethylphenyl)- 1- [4- (trifluoromethyl)phenyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)C(F)(F)F)Nc1ccc(c(c1)C)C

STK539153
Synonyms: 3- (1H- benzimidazol- 2- yl)- N'- [(E)- (3,5- dibromo- 2- hydroxyphenyl)methylidene]propanehydrazide
Smiles: O=C(CCc1nc2c([nH]1)cccc2)N/N=C/c1cc(Br)cc(c1O)Br

STK539154
Synonyms: N'- [(E)- (3- chlorophenyl)methylidene]- 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1cccc(c1)Cl

STK539155
Synonyms: 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N'- [(E)- pyridin- 2- ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1ccccn1

STK539156
Synonyms: 9- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 8- (prop- 2- en- 1- yl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: C=CCn1c(SCC(=O)c2ccc(cc2)Cl)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK539157
Synonyms: 7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 1,3- dimethyl- 8- sulfanyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(S)nc2c1c(=O)n(C)c(=O)n2C)COc1ccccc1C

STK539158
Synonyms: 8- butoxy- 5- (2- methylpropyl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: CCCCOc1ncnc2c1sc1c2c2CCCCc2c(n1)CC(C)C

STK539160
Synonyms: 2- (dimethylamino)ethyl1H- indole- 3- carboxylate
Smiles: CN(CCOC(=O)c1c[nH]c2c1cccc2)C

STK539162
Synonyms: 8- [benzyl(methyl)amino]- 3- methyl- 7- nonyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N(Cc1ccccc1)C

STK539163
Synonyms: 2- [(2,6- dichlorobenzyl)sulfanyl]- 6- methyl- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydro- 1,6- naphthyridine- 3- carbonitrile
Smiles: N#Cc1c(SCc2c(Cl)cccc2Cl)nc2c(c1c1cccs1)CN(CC2)C

STK539165
Synonyms: (2E)- N- (2,4- dichlorophenyl)- 2- (3,4- dimethoxybenzylidene)hydrazinecarbothioamide
Smiles: COc1cc(/C=N/NC(=S)Nc2ccc(cc2Cl)Cl)ccc1OC

STK539167
Synonyms: 4- fluoro- N- {3- [(4- methylphenyl)sulfonyl]- 1- (1- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(NS(=O)(=O)c2ccc(cc2)F)n(c2c1nc1ccccc1n2)C(c1ccccc1)C

STK539168
Synonyms: methyl2- {[3- (piperidin- 1- yl)quinoxalin- 2- yl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(Nc2nc3ccccc3nc2N2CCCCC2)sc2c1CCCC2

STK539170
Synonyms: 1- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 4- (3- methylphenyl)- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CCC3

STK539172
Synonyms: 5- (4- bromophenyl)- 1- (4- methylphenyl)- 3- [(4- methylphenyl)amino]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Cc1ccc(cc1)NC1=CC(N(C1=O)c1ccc(cc1)C)c1ccc(cc1)Br

STK539174
Synonyms: 1,3- dimethyl- 8- [(2Z)- 2- (1- phenylethylidene)hydrazinyl]- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(N/N=C(\c2ccccc2)/C)nc2c1c(=O)n(c(=O)n2C)C

STK539175
Synonyms: N- (4- methylphenyl)- 2- {[3- (4- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3

STK539176
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- {(E)- [3- methoxy- 4- (propan- 2- yloxy)phenyl]methylidene}acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cn2nnc(n2)N)ccc1OC(C)C

STK539178
Synonyms: methyl3- {[(4- fluorophenyl)carbonyl]amino}- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1ccc(cc1)F)cc(cc2)C

STK539179
Synonyms: 9- bromo- 5- (2- chlorophenyl)- 2- (4- ethoxyphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: CCOc1ccc(cc1)C1=NN2C(C1)c1cc(Br)ccc1OC2c1ccccc1Cl

STK539180
Synonyms: N'- [(E)- (3- methoxy- 4- propoxyphenyl)methylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: CCCOc1ccc(cc1OC)/C=N/NC(=O)CSc1ccccn1

STK539181
Synonyms: ethyl2- {[5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl]sulfanyl}propanoate
Smiles: CCOC(=O)C(Sc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1)C

STK539182
Synonyms: (2E)- N- (2,4- dichlorophenyl)- 2- {[5- (4- fluorophenyl)- 1H- pyrazol- 4- yl]methylidene}hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1Cl)Cl)N/N=C/c1cn[nH]c1c1ccc(cc1)F

STK539183
Synonyms: N- {1- butyl- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}naphthalene- 2- sulfonamide
Smiles: CCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc2c(c1)cccc2)S(=O)(=O)c1ccc(cc1)C

STK539185
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (5- phenyl- 1H- pyrazol- 4- yl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1cn[nH]c1c1ccccc1

STK539187
Synonyms: 8- [(2Z)- 2- (5- bromo- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)hydrazinyl]- 1,3- dimethyl- 7- (4- methylbenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1ccc(cc1)Cn1c(N/N=C/2\C(=O)Nc3c2cc(Br)cc3)nc2c1c(=O)n(c(=O)n2C)C

STK539188
Synonyms: (2E)- N- (2,4- dichlorophenyl)- 2- [3- methoxy- 4- (propan- 2- yloxy)benzylidene]hydrazinecarbothioamide
Smiles: COc1cc(/C=N/NC(=S)Nc2ccc(cc2Cl)Cl)ccc1OC(C)C

STK539189
Synonyms: (2E)- N- (2,4- dichlorophenyl)- 2- (2- methoxybenzylidene)hydrazinecarbothioamide
Smiles: COc1ccccc1/C=N/NC(=S)Nc1ccc(cc1Cl)Cl

STK539191
Synonyms: 7- ethyl- 1,3- dimethyl- 8- {(2Z)- 2- [1- (4- nitrophenyl)ethylidene]hydrazinyl}- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(N/N=C(\c2ccc(cc2)[N+](=O)[O-])/C)nc2c1c(=O)n(c(=O)n2C)C

STK539192
Synonyms: 2- (1,3- benzothiazol- 2- ylsulfanyl)- N'- [(1E)- 1- phenylpropylidene]acetohydrazide
Smiles: CC/C(=N\NC(=O)CSc1nc2c(s1)cccc2)/c1ccccc1

STK539193
Synonyms: 2- cyclopropyl- N'- [(1E)- 1- (naphthalen- 2- yl)ethylidene]quinoline- 4- carbohydrazide
Smiles: C/C(=N\NC(=O)c1cc(nc2c1cccc2)C1CC1)/c1ccc2c(c1)cccc2

STK539194
Synonyms: N,N- bis(4- tert- butylphenyl)furan- 2- carboxamide
Smiles: O=C(N(c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C)c1ccco1

STK539196
Synonyms: N'- {(E)- [2- (benzyloxy)phenyl]methylidene}- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/c1ccccc1OCc1ccccc1

STK539197
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (3- phenoxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1cccc(c1)Oc1ccccc1

STK539198
Synonyms: methyl3- ({[4- (3- chlorophenyl)piperazin- 1- yl]acetyl}amino)- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)Cl)cc(cc2)C

STK539199
Synonyms: methyl3- {[ethoxy(oxo)acetyl]amino}- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)C(=O)Nc1c([nH]c2c1cc(OC)c(c2)OC)C(=O)OC

STK539205
Synonyms: (8R,8aR)- 6- amino- 8- (2,5- dimethoxyphenyl)- 2- (propan- 2- yl)- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)C(C)C)c1cc(OC)ccc1OC)(C#N)C#N

STK539206
Synonyms: 6- hydroxy- N- [2- (morpholin- 4- yl)ethyl]- 4- oxo- 1,2- dihydro- 4H- pyrrolo[3,2,1- ij]quinoline- 5- carboxamide
Smiles: O=C(c1c(O)c2cccc3c2n(c1=O)CC3)NCCN1CCOCC1

STK539208
Synonyms: (1'R,3R,3'R)- 1'- [(4- bromophenyl)carbonyl]- 3'- {[4- (2- methylpropyl)phenyl]carbonyl}- 3',3a'- dihydrospiro[indole- 3,2'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: CC(Cc1ccc(cc1)C(=O)[C@H]1C2C=Cc3c(N2[C@H]([C@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)Br)cccc3)C

STK539210
Synonyms: 2- [(2E)- 2- (5- bromo- 2,4- dimethoxybenzylidene)hydrazinyl]- 4,6- dimethylpyrimidine
Smiles: COc1cc(OC)c(cc1/C=N/Nc1nc(C)cc(n1)C)Br

STK539212
Synonyms: 4- (4- ethylpiperazin- 1- yl)- 5- (4- methoxyphenyl)thieno[2,3- d]pyrimidine
Smiles: CCN1CCN(CC1)c1ncnc2c1c(cs2)c1ccc(cc1)OC

STK539213
Synonyms: methyl3- {[(3- methoxyphenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COc1cccc(c1)C(=O)Nc1c([nH]c2c1cccc2)C(=O)OC

STK539215
Synonyms: ethyl2- amino- 4- {2- [(4- chlorobenzyl)oxy]phenyl}- 7,7- dimethyl- 5- oxo- 5,6,7,8- tetrahydro- 4H- chromene- 3- carboxylate
Smiles: CCOC(=O)C1=C(N)OC2=C(C1c1ccccc1OCc1ccc(cc1)Cl)C(=O)CC(C2)(C)C

STK539216
Synonyms: 2- {4- [(8S)- 6- amino- 5,7,7- tricyano- 2- methyl- 1,2,3,7,8,8a- hexahydroisoquinolin- 8- yl]- 2- methoxyphenoxy}acetamide
Smiles: N#CC1=C(N)C([C@@H](C2C1=CCN(C2)C)c1ccc(c(c1)OC)OCC(=O)N)(C#N)C#N

STK539217
Synonyms: 7- benzyl- 2- (benzylsulfanyl)- 3- (2- methylphenyl)- 5,6,7,8- tetrahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: Cc1ccccc1n1c(SCc2ccccc2)nc2c(c1=O)c1CCN(Cc1s2)Cc1ccccc1

STK539218
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (5- chloro- 3- methyl- 1- phenyl- 1H- pyrazol- 4- yl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1c(C)nn(c1Cl)c1ccccc1

STK539219
Synonyms: (6aR,6bS,9aR,10S)- 10- [(4- bromophenyl)carbonyl]- 8- [3- (trifluoromethyl)phenyl]- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Brc1ccc(cc1)C(=O)[C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1cccc(c1)C(F)(F)F)C=Cc1c2cccc1

STK539220
Synonyms: 7- (4- {[(2,4- dichlorophenyl)carbonyl]carbamothioyl}piperazin- 1- yl)- 1- ethyl- 6- fluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=S)NC(=O)c1ccc(cc1Cl)Cl)c(c2)F

STK539221
Synonyms: N'- [(E)- (5- chloro- 3- methyl- 1- phenyl- 1H- pyrazol- 4- yl)methylidene]- 2- phenylquinoline- 4- carbohydrazide
Smiles: Cc1nn(c(c1/C=N/NC(=O)c1cc(nc2c1cccc2)c1ccccc1)Cl)c1ccccc1

STK539224
Synonyms: 2- ({[4- benzyl- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)- N- ethylhydrazinecarbothioamide
Smiles: CCNC(=S)NNC(=O)CSc1nnc(n1Cc1ccccc1)c1ccncc1

STK539225
Synonyms: N- phenyl- 2- [(5- propyl- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl)sulfanyl]propanamide
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncnc3SC(C(=O)Nc1ccccc1)C

STK539227
Synonyms: (1'R,3R,3'R)- 1'- acetyl- 3'- [(4- fluorophenyl)carbonyl]- 3',3a'- dihydrospiro[indole- 3,2'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: Fc1ccc(cc1)C(=O)[C@H]1C2C=Cc3c(N2[C@H]([C@]21C(=O)Nc1c2cccc1)C(=O)C)cccc3

STK539228
Synonyms: 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N- phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3

STK539229
Synonyms: ethyl[(Z)- 2- chloro- 2- phenylethenyl][(4- fluorophenyl)(hydroxy)methyl]phosphinate
Smiles: CCOP(=O)(C(c1ccc(cc1)F)O)/C=C(/c1ccccc1)\Cl

STK539230
Synonyms: (6aS,6bR,9aS,10R)- 10- acetyl- 8- (2- methyl- 5- nitrophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: O=C1N(c2cc(ccc2C)[N+](=O)[O-])C(=O)[C@H]2[C@@H]1[C@@H]1C=Cc3c(N1[C@H]2C(=O)C)cccc3

STK539231
Synonyms: 3,6- diamino- N- (2- chlorobenzyl)- 5- cyanothieno[2,3- b]pyridine- 2- carboxamide
Smiles: N#Cc1cc2c(nc1N)sc(c2N)C(=O)NCc1ccccc1Cl

STK539232
Synonyms: 2- [(4- ethylphenyl)(phenyl)methylidene]- 1H- indene- 1,3(2H)- dione
Smiles: CCc1ccc(cc1)/C(=C/1\C(=O)c2c(C1=O)cccc2)/c1ccccc1

STK539233
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- anthracen- 9- ylmethylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1c2ccccc2cc2c1cccc2

STK539234
Synonyms: (3E)- 3- (morpholin- 4- ylimino)- 1,3- dihydro- 2H- indol- 2- one
Smiles: O=C1Nc2c(/C/1=N\N1CCOCC1)cccc2

STK539235
Synonyms: 2- [(2E)- 2- (3- bromobenzylidene)hydrazinyl]- 4,6- dimethylpyrimidine
Smiles: Brc1cccc(c1)/C=N/Nc1nc(C)cc(n1)C

STK539237
Synonyms: (9E)- 9- benzylidene- 3- (4- chlorophenyl)- 5- phenyl- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: Clc1ccc(cc1)c1csc2=NC3=C(C(n12)c1ccccc1)CCC/C/3=C\c1ccccc1

STK539238
Synonyms: (2E)- N- (2,4- dichlorophenyl)- 2- (4- hydroxybenzylidene)hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1Cl)Cl)N/N=C/c1ccc(cc1)O

STK539239
Synonyms: (3- methyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl)aceticacid
Smiles: OC(=O)Cn1cnc2c1c(=O)[nH]c(=O)n2C

STK539240
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (2- hydroxy- 5- nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1cc(ccc1O)[N+](=O)[O-]

STK539241
Synonyms: (1'R,3R,3'R,3a'S)- 1'- [(4- bromophenyl)carbonyl]- 3'- [(4- methoxyphenyl)carbonyl]- 3',3a'- dihydrospiro[indole- 3,2'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: COc1ccc(cc1)C(=O)[C@H]1[C@@H]2C=Cc3c(N2[C@H]([C@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)Br)cccc3

STK539242
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (4- fluorophenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1ccc(cc1)F

STK539244
Synonyms: 7- [3- (4- ethylphenoxy)- 2- hydroxypropyl]- 3- methyl- 8- sulfanyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCc1ccc(cc1)OCC(Cn1c(S)nc2c1c(=O)[nH]c(=O)n2C)O

STK539245
Synonyms: N- (furan- 2- ylmethyl)- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: O=c1ccc(co1)C(=O)NCc1ccco1

STK539246
Synonyms: ethyl8- methyl- 4- (naphthalen- 1- ylamino)quinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1cccc3c1cccc3)cccc2C

STK539247
Synonyms: 6- ethyl- 4- imino- 2,6- dimethyl- 5,8- dihydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 3(6H)- amine
Smiles: CCC1(C)OCc2c(C1)c1c(s2)nc(n(c1=N)N)C

STK539249
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (5- bromo- 2,4- dimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)Cn1nnc(n1)N)Br

STK539250
Synonyms: N'- [(E)- (3- hydroxyphenyl)methylidene]- 6- oxo- 1,6- dihydropyridazine- 3- carbohydrazide
Smiles: Oc1cccc(c1)/C=N/NC(=O)c1ccc(=O)[nH]n1

STK539251
Synonyms: N'- {(E)- [4- (diethylamino)phenyl]methylidene}- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: CCN(c1ccc(cc1)/C=N/NC(=O)Cn1ncnc1)CC

STK539252
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- pyridin- 3- ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1cccnc1

STK539253
Synonyms: N'- [(E)- {2- [(4- bromobenzyl)oxy]phenyl}methylidene]- 2- cyclopropylquinoline- 4- carbohydrazide
Smiles: Brc1ccc(cc1)COc1ccccc1/C=N/NC(=O)c1cc(nc2c1cccc2)C1CC1

STK539256
Synonyms: 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N'- [(1E)- 1- phenylbutylidene]acetohydrazide
Smiles: CCC/C(=N\NC(=O)CSc1nnc(n1C)c1ccccc1)/c1ccccc1

STK539257
Synonyms: methyl2- [11- (4- ethoxyphenyl)- 2- ethyl- 4- oxo- 4,11- dihydro- 3H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 3- yl]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCOc1ccc(cc1)n1c2nc(CC)n(c(=O)c2c2c1nc1ccccc1n2)c1sc2c(c1C(=O)OC)CCCC2

STK539258
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 3- cyclohexyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Clc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1C1CCCCC1)CCCCC3

STK539260
Synonyms: 8- {[2- (diethylamino)ethyl]amino}- 7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCN(CCNc1nc2c(n1CC(COc1ccccc1C)O)c(=O)[nH]c(=O)n2C)CC

STK539261
Synonyms: (1'R,3R,3'R)- 1'- [(4- bromophenyl)carbonyl]- 3'- [(4- propylphenyl)carbonyl]- 3',3a'- dihydrospiro[indole- 3,2'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: CCCc1ccc(cc1)C(=O)[C@H]1C2C=Cc3c(N2[C@H]([C@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)Br)cccc3

STK539262
Synonyms: N- (2- methylphenyl)- 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)Nc2ccccc2C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK539263
Synonyms: 4- (heptyloxy)- 2,8,8- trimethyl- 7,10- dihydro- 8H- pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CCCCCCCOc1nc(C)nc2c1sc1c2cc2c(n1)CC(OC2)(C)C

STK539264
Synonyms: methyl3- ({[4- (4- fluorophenyl)piperazin- 1- yl]acetyl}amino)- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)cc(c(c2)OC)OC

STK539265
Synonyms: 3- [(4- ethylpiperazin- 1- yl)methyl]- 2,6,8- trimethylquinolin- 4- ol
Smiles: CCN1CCN(CC1)Cc1c(C)nc2c(c1O)cc(cc2C)C

STK539266
Synonyms: 7- (2,3- dihydroxypropyl)- 3- methyl- 8- {(2Z)- 2- [1- (4- nitrophenyl)ethylidene]hydrazinyl}- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCC(Cn1c(N/N=C(\c2ccc(cc2)[N+](=O)[O-])/C)nc2c1c(=O)[nH]c(=O)n2C)O

STK539267
Synonyms: methyl3- [(2- bromohexanoyl)amino]- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCCCC(C(=O)Nc1c([nH]c2c1cc(F)cc2)C(=O)OC)Br

STK539268
Synonyms: 10- methyl- N- (4- methylphenyl)- 8- phenyl- 11- (thiophen- 2- yl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cccs1)C)c1ccccc1

STK539269
Synonyms: N'- [(E)- (5- chloro- 3- methyl- 1- phenyl- 1H- pyrazol- 4- yl)methylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/c1c(C)nn(c1Cl)c1ccccc1

STK539270
Synonyms: N'- [(E)- {3- [(1,3- benzoxazol- 2- ylsulfanyl)methyl]- 4- methoxyphenyl}methylidene]- 3- (2,2- dichloroethenyl)- 2,2- dimethylcyclopropanecarbohydrazide
Smiles: COc1ccc(cc1CSc1nc2c(o1)cccc2)/C=N/NC(=O)C1C(C1(C)C)C=C(Cl)Cl

STK539271
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (3- nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1cccc(c1)[N+](=O)[O-]

STK539272
Synonyms: (6aS,6bR,9aS,10R)- 10- [(4- methoxyphenyl)carbonyl]- 8- (2- methyl- 5- nitrophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1cc(ccc1C)[N+](=O)[O-])C=Cc1c2cccc1

STK539273
Synonyms: 4- (3- methylphenyl)- 7- (propan- 2- yl)- 1- (prop- 2- en- 1- ylsulfanyl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: C=CCSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CC(OC3)C(C)C

STK539274
Synonyms: 2- [(2E)- 2- {2- [(3- bromobenzyl)oxy]benzylidene}hydrazinyl]- 4,6- dimethylpyrimidine
Smiles: Brc1cccc(c1)COc1ccccc1/C=N/Nc1nc(C)cc(n1)C

STK539275
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(1E,2E)- 3- phenylprop- 2- en- 1- ylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/C=C/c1ccccc1

STK539277
Synonyms: N'- [(E)- anthracen- 9- ylmethylidene]- 2- [4- (1H- tetrazol- 1- yl)phenoxy]acetohydrazide
Smiles: O=C(COc1ccc(cc1)n1cnnn1)N/N=C/c1c2ccccc2cc2c1cccc2

STK539278
Synonyms: N- {3- [(4- methylphenyl)sulfonyl]- 1- pentyl- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}naphthalene- 2- sulfonamide
Smiles: CCCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc2c(c1)cccc2)S(=O)(=O)c1ccc(cc1)C

STK539279
Synonyms: 7- ethyl- 8- [(2E)- 2- (4- fluorobenzylidene)hydrazinyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(N/N=C/c2ccc(cc2)F)nc2c1c(=O)n(c(=O)n2C)C

STK539281
Synonyms: (3E)- 3- [2- oxo- 2- (4- pentylphenyl)ethylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: CCCCCc1ccc(cc1)C(=O)/C=C\1/C(=O)Nc2c1cccc2

STK539282
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (3- methoxy- 4- propoxyphenyl)methylidene]acetohydrazide
Smiles: CCCOc1ccc(cc1OC)/C=N/NC(=O)Cn1nnc(n1)N

STK539283
Synonyms: N- (3- chlorophenyl)- 2,2,3,3,4,4,4- heptafluorobutanamide
Smiles: Clc1cccc(c1)NC(=O)C(C(C(F)(F)F)(F)F)(F)F

STK539284
Synonyms: (9E)- 9- (2- chlorobenzylidene)- 5- (2- chlorophenyl)- 3- (4- methoxyphenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: COc1ccc(cc1)c1csc2=NC3=C(C(n12)c1ccccc1Cl)CCC/C/3=C\c1ccccc1Cl

STK539285
Synonyms: 3- {[(E)- (4- nitrophenyl)methylidene]amino}- 2- propylquinazolin- 4(3H)- one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1ccc(cc1)[N+](=O)[O-]

STK539286
Synonyms: (9E)- 3- (4- chlorophenyl)- 9- (4- methylbenzylidene)- 5- (4- methylphenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: Cc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Cl)/C(=C/c1ccc(cc1)C)/CCC2

STK539288
Synonyms: 8- methyl- 3,5- dihydro- 4H- pyridazino[4,5- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1cn[nH]c(=O)c1[nH]2

STK539290
Synonyms: ethylN- [4- chloro- 6- (piperidin- 1- yl)- 1,3,5- triazin- 2- yl]glycinate
Smiles: CCOC(=O)CNc1nc(Cl)nc(n1)N1CCCCC1

STK539291
Synonyms: 2- (2- hydroxyphenyl)- 3- methyl- 2,3,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 4(1H)- one
Smiles: Oc1ccccc1C1Nc2sc3c(c2C(=O)N1C)CCCC3

STK539293
Synonyms: 7- hexyl- 3- methyl- 8- [(4- methylbenzyl)amino]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCn1c(NCc2ccc(cc2)C)nc2c1c(=O)[nH]c(=O)n2C

STK539295
Synonyms: 2- [(2E)- 2- (2,4- dichlorobenzylidene)hydrazinyl]- 4,6- dimethylpyrimidine
Smiles: Clc1ccc(c(c1)Cl)/C=N/Nc1nc(C)cc(n1)C

STK539297
Synonyms: ethyl3- [(2- bromo- 3- methylbutanoyl)amino]- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C(C(C)C)Br)cc(cc2)OC

STK539298
Synonyms: 6- amino- 4- (3- methoxyphenyl)- 3- methyl- 1- (4- methylphenyl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: COc1cccc(c1)C1C(=C(N)Oc2c1c(C)nn2c1ccc(cc1)C)C#N

STK539299
Synonyms: N'- {(E)- [4- (dimethylamino)phenyl]methylidene}- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: CN(c1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1C)c1ccccc1)C

STK539300
Synonyms: 2- [(2E)- 2- {2- [(4- chlorobenzyl)oxy]benzylidene}hydrazinyl]- 4,6- dimethylpyrimidine
Smiles: Clc1ccc(cc1)COc1ccccc1/C=N/Nc1nc(C)cc(n1)C

STK539301
Synonyms: 4- [6- (4- fluorophenoxy)hexyl]thiomorpholine
Smiles: Fc1ccc(cc1)OCCCCCCN1CCSCC1

STK539302
Synonyms: (6aS,6bR,9aS,10R)- 10- [(4- bromophenyl)carbonyl]- 3- chloro- 8- (2- methyl- 5- nitrophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1cc(ccc1C)[N+](=O)[O-])C=Cc1c2ccc(c1)Cl

STK539303
Synonyms: 3- benzyl- 2- [(2- methylprop- 2- en- 1- yl)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(=C)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(OC3)C(C)C

STK539304
Synonyms: N'- [(E)- (4- chlorophenyl)methylidene]- 2- cyclopropylquinoline- 4- carbohydrazide
Smiles: Clc1ccc(cc1)/C=N/NC(=O)c1cc(nc2c1cccc2)C1CC1

STK539305
Synonyms: 3- {[(E)- (3- nitrophenyl)methylidene]amino}- 2- propylquinazolin- 4(3H)- one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1cccc(c1)[N+](=O)[O-]

STK539306
Synonyms: 3- (furan- 2- ylmethyl)- 11- (4- methylphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Cc1ccc(cc1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)Cc1ccco1

STK539308
Synonyms: 2- {[4- benzyl- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (2,3- dimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cccc(c1OC)/C=N/NC(=O)CSc1nnc(n1Cc1ccccc1)c1ccncc1

STK539309
Synonyms: pentyl{[3- (3- methylphenyl)- 4- oxo- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}acetate
Smiles: CCCCCOC(=O)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C

STK539310
Synonyms: 6- [3- ({4,6- bis[(2,4- dimethylphenyl)amino]- 1,3,5- triazin- 2- yl}sulfanyl)- 4H- 1,2,4- triazol- 4- yl]- N,N'- bis(2,4- dimethylphenyl)- 1,3,5- triazine- 2,4- diamine
Smiles: Cc1ccc(c(c1)C)Nc1nc(nc(n1)Sc1nncn1c1nc(nc(n1)Nc1ccc(cc1C)C)Nc1ccc(cc1C)C)Nc1ccc(cc1C)C

STK539312
Synonyms: ethyl4- {[(3,5- dinitrophenyl)carbonyl]amino}- 3- ethyl- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carboxylate
Smiles: CCOC(=O)c1sc(=S)n(c1NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])CC

STK539313
Synonyms: 3- {[7- chloro- 3- (ethoxycarbonyl)- 8- methylquinolin- 4- yl]amino}benzoicacid
Smiles: CCOC(=O)c1cnc2c(c1Nc1cccc(c1)C(=O)O)ccc(c2C)Cl

STK539314
Synonyms: tert- butyl(8S,8aR)- 6- amino- 5,7,7- tricyano- 8- [3- ethoxy- 4- (propan- 2- yloxy)phenyl]- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCOc1cc(ccc1OC(C)C)[C@@H]1[C@H]2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(=O)OC(C)(C)C

STK539315
Synonyms: N'- [(1E)- 1- (2,4- dimethoxyphenyl)ethylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: COc1cc(OC)ccc1/C(=N/NC(=O)Cn1cncn1)/C

STK539316
Synonyms: methyl3- ({[4- (3- chlorophenyl)piperazin- 1- yl]acetyl}amino)- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)Cl)cc(c(c2)OC)OC

STK539317
Synonyms: N- (4- chlorophenyl)- 2- {[5- (2- methylpropyl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl]sulfanyl}acetamide
Smiles: CC(Cc1nc2sc3c(c2c2c1CCCC2)ncnc3SCC(=O)Nc1ccc(cc1)Cl)C

STK539318
Synonyms: 5- (morpholin- 4- yl)- 8- [(2- phenoxyethyl)sulfanyl]- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: O1CCN(CC1)c1nc2sc3c(c2c2c1CCCC2)ncnc3SCCOc1ccccc1

STK539320
Synonyms: 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N- (2- methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3

STK539321
Synonyms: 2- [7- (4- methylpiperazin- 1- yl)- 7- oxoheptyl]- 1H- isoindole- 1,3(2H)- dione
Smiles: CN1CCN(CC1)C(=O)CCCCCCN1C(=O)c2c(C1=O)cccc2

STK539322
Synonyms: N'- [(E)- {4- [(3,4- dichlorobenzyl)oxy]- 3- methoxyphenyl}methylidene]- 2- methylquinoline- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2cc(C)nc3c2cccc3)ccc1OCc1ccc(c(c1)Cl)Cl

STK539323
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (5- nitrothiophen- 2- yl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1ccc(s1)[N+](=O)[O-]

STK539324
Synonyms: (E)- N- {[8,9- bis(4- methoxyphenyl)furo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}- 1- phenylmethanimine
Smiles: COc1ccc(cc1)c1c(oc2c1c1nc(nn1cn2)CO/N=C/c1ccccc1)c1ccc(cc1)OC

STK539326
Synonyms: (7E)- N- methyl- 7- (methylimino)cyclohepta- 1,3,5- trien- 1- amine
Smiles: C/N=c/1\cccccc1NC

STK539327
Synonyms: 4- [3- acetyl- 4- hydroxy- 2- (3- nitrophenyl)- 5- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl]butanoicacid
Smiles: OC(=O)CCCN1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)C

STK539328
Synonyms: N- (3- acetylphenyl)- 2,2,3,3,4,4,5,5,6,6,7,7,7- tridecafluoroheptanamide
Smiles: O=C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Nc1cccc(c1)C(=O)C

STK539329
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- {2- [(4- chlorobenzyl)oxy]phenyl}methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1ccccc1OCc1ccc(cc1)Cl

STK539330
Synonyms: 2- [(2,4- dichlorobenzyl)sulfanyl]- 3- (4- methoxyphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2Cl)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK539331
Synonyms: (8R,8aR,11aS,11bS)- 8- acetyl- 10- (3- fluorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Fc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@H]2C(=O)C)C=Cc2c1cccc2

STK539332
Synonyms: 3- (furan- 2- ylmethyl)- 11- (3- methoxyphenyl)- 2- methyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1cccc(c1)n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)Cc1ccco1

STK539333
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (2- hydroxy- 3- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cccc(c1O)/C=N/NC(=O)CSc1nnc(n1C)c1cccc(c1)Br

STK539334
Synonyms: (6aR,6bS,9aR,10S)- 8- (2- methoxyphenyl)- 10- (phenylcarbonyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)c1ccccc1

STK539335
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (4- hydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1ccc(cc1)O

STK539336
Synonyms: 1- ethyl- 6- fluoro- 7- (4- octanoylpiperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCCCCCCC(=O)N1CCN(CC1)c1cc2n(CC)cc(c(=O)c2cc1F)C(=O)O

STK539337
Synonyms: methyl3- {[2- (4- benzylpiperidin- 1- yl)propanoyl]amino}- 5- chloro- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C(N1CCC(CC1)Cc1ccccc1)C)cc(cc2)Cl

STK539338
Synonyms: (8R,8aR)- 6- amino- 8- (2,3- dimethoxyphenyl)- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCNC2)c1cccc(c1OC)OC)(C#N)C#N

STK539339
Synonyms: N'- [(E)- (3- methoxyphenyl)methylidene]- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: COc1cccc(c1)/C=N/NC(=O)CSc1nnc(n1C)c1ccccc1

STK539340
Synonyms: N'- [(E)- (2- chlorophenyl)methylidene]- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1ccccc1Cl

STK539342
Synonyms: methyl2- {[(pyridin- 3- ylcarbonyl)carbamothioyl]amino}- 4,5,6,7,8,9,10,11,12,13- decahydrocyclododeca[b]thiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC(=S)NC(=O)c2cccnc2)sc2c1CCCCCCCCCC2

STK539343
Synonyms: (5E)- 2- [4- (3- chloro- 4- methylphenyl)piperazin- 1- yl]- 5- (4- propoxybenzylidene)- 1,3- thiazol- 4(5H)- one
Smiles: CCCOc1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccc(c(c1)Cl)C

STK539344
Synonyms: 8- {(2E)- 2- [(2E)- 2- bromo- 3- phenylprop- 2- en- 1- ylidene]hydrazinyl}- 1,3- dimethyl- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(N/N=C/C(=C\c2ccccc2)/Br)nc2c1c(=O)n(c(=O)n2C)C

STK539345
Synonyms: N'- [(E)- (3- {[4- chloro- 5- methyl- 2- (propan- 2- yl)phenoxy]methyl}- 4- methoxyphenyl)methylidene]- 6- oxo- 1,6- dihydropyridazine- 3- carbohydrazide
Smiles: COc1ccc(cc1COc1cc(C)c(cc1C(C)C)Cl)/C=N/NC(=O)c1ccc(=O)[nH]n1

STK539347
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(Z)- {2- [(4- nitrobenzyl)oxy]phenyl}methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C\c1ccccc1OCc1ccc(cc1)[N+](=O)[O-]

STK539348
Synonyms: N- (3,4- dichlorophenyl)- 10- methyl- 8- phenyl- 11- (thiophen- 2- yl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1nn(c2c1C(c1cccs1)n1c(=N2)c(Nc2ccc(c(c2)Cl)Cl)nc2c1cccc2)c1ccccc1

STK539349
Synonyms: (9E)- 3- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 9- (4- ethoxybenzylidene)- 5- (4- ethoxyphenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: CCOc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc3c(c1)OCCO3)/C(=C/c1ccc(cc1)OCC)/CCC2

STK539350
Synonyms: (8S,8aR)- 6- amino- 8- (3- bromo- 4- methoxyphenyl)- 2- methyl- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)C)c1ccc(c(c1)Br)OC)(C#N)C#N

STK539351
Synonyms: 11- (propan- 2- yl)- 3- (prop- 2- en- 1- ylsulfanyl)- 7,8,9,10- tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: C=CCSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)C(C)C

STK539353
Synonyms: (9E)- 3- (4- chlorophenyl)- 9- [4- (difluoromethoxy)benzylidene]- 5- [4- (difluoromethoxy)phenyl]- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: FC(Oc1ccc(cc1)/C=C/1\CCCC2=C1N=c1scc(n1C2c1ccc(cc1)OC(F)F)c1ccc(cc1)Cl)F

STK539354
Synonyms: 2'- imino- 2- oxohexahydro- 2'H- spiro[cyclohexane- 1,4'- [1]oxa[3,9a]methano[1]benzoxepine]- 3',10',10'- tricarbonitrile
Smiles: N#CC1(C#N)C23CCCCC3CC3(C1(C#N)C(=N)O2)CCCCC3=O

STK539356
Synonyms: 6- {[2- (diethylamino)ethyl]amino}- 3,3- dimethyl- 8- (2- methylpropyl)- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: CCN(CCNc1nc(CC(C)C)c2c(c1C#N)CC(OC2)(C)C)CC

STK539357
Synonyms: 5- (4- fluorophenyl)- 3- hydroxy- 1- (4- methoxyphenyl)- 4- (phenylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)N1C(=O)C(=C(C1c1ccc(cc1)F)C(=O)c1ccccc1)O

STK539358
Synonyms: 2- {[3- benzyl- 4- oxo- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}acetamide
Smiles: NC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(OC3)C(C)C

STK539359
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- [(3R)- 4- (3- methoxyphenyl)- 3- methylpiperazin- 1- yl]ethanone
Smiles: COc1cccc(c1)N1CCN(CC1C)CC(=O)c1c(C)[nH]c2c1ccc(c2)C

STK539360
Synonyms: methyl3- {[(2- methylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCCCC1C)cccc2

STK539361
Synonyms: 3- (2- chloro- 1H- benzimidazol- 1- yl)propanenitrile
Smiles: N#CCCn1c(Cl)nc2c1cccc2

STK539362
Synonyms: N'- (4,6- dimethyl- 2- {[4- (pyrimidin- 2- yl)piperazin- 1- yl]carbonyl}thieno[2,3- b]pyridin- 3- yl)- N,N- dimethylimidoformamide
Smiles: CN(/C=N/c1c(sc2c1c(C)cc(n2)C)C(=O)N1CCN(CC1)c1ncccn1)C

STK539365
Synonyms: N- (furan- 2- ylmethyl)- N'- (5- propyl- 1,3,4- thiadiazol- 2- yl)ethanediamide
Smiles: CCCc1nnc(s1)NC(=O)C(=O)NCc1ccco1

STK539367
Synonyms: 2- (heptylsulfanyl)- 3- (3- methylphenyl)- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C

STK539368
Synonyms: 8- {(2E)- 2- [(2Z)- 2- chloro- 3- (4- nitrophenyl)prop- 2- en- 1- ylidene]hydrazinyl}- 7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(N/N=C/C(=C/c2ccc(cc2)[N+](=O)[O-])/Cl)nc2c1c(=O)n(c(=O)n2C)C)COc1ccccc1C

STK539369
Synonyms: 2- cyclopropyl- N'- [(E)- (4- hydroxy- 3- methoxyphenyl)methylidene]quinoline- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2cc(nc3c2cccc3)C2CC2)ccc1O

STK539370
Synonyms: 2- propyl- 3- {[(1E)- 1- (pyridin- 4- yl)ethylidene]amino}quinazolin- 4(3H)- one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C(/c1ccncc1)\C

STK539371
Synonyms: ethyl{[5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl]sulfanyl}(phenyl)acetate
Smiles: CCOC(=O)C(c1ccccc1)Sc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK539373
Synonyms: N'- [(E)- anthracen- 9- ylmethylidene]- 2- cyclopropylquinoline- 4- carbohydrazide
Smiles: O=C(c1cc(nc2c1cccc2)C1CC1)N/N=C/c1c2ccccc2cc2c1cccc2

STK539376
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (4- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)Cn1nnc(n1)N

STK539377
Synonyms: 8- chloro- 2,2- dimethyl- 5- phenyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: Clc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccccc1

STK539378
Synonyms: N'- [(E)- (2- hydroxy- 3- methoxy- 5- nitrophenyl)methylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: COc1cc(cc(c1O)/C=N/NC(=O)Cn1cncn1)[N+](=O)[O-]

STK539379
Synonyms: 3- (3- methylphenyl)- 2- [(2- methylprop- 2- en- 1- yl)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(=C)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C

STK539380
Synonyms: 2- [4- (5- chloro- 2- methylphenyl)piperazin- 1- yl]- 1- (8- methyl- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)ethanone
Smiles: Clc1ccc(c(c1)N1CCN(CC1)CC(=O)N1CCc2c(C1)c1cc(C)ccc1[nH]2)C

STK539381
Synonyms: 3- (4- bromophenyl)- 2- pentylquinazolin- 4(3H)- one
Smiles: CCCCCc1nc2ccccc2c(=O)n1c1ccc(cc1)Br

STK539382
Synonyms: 4- (4- methoxyphenyl)- 3- methyl- 1- phenyl- 4,8- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7(6H)- one
Smiles: COc1ccc(cc1)C1SCC(=O)Nc2c1c(C)nn2c1ccccc1

STK539383
Synonyms: 3- {[(E)- (2- hydroxynaphthalen- 1- yl)methylidene]amino}- 2- [(2- methylphenoxy)methyl]quinazolin- 4(3H)- one
Smiles: Cc1ccccc1OCc1nc2ccccc2c(=O)n1/N=C/c1c(O)ccc2c1cccc2

STK539384
Synonyms: 2- (1,3- benzothiazol- 2- ylsulfanyl)- N'- [(E)- {2- [(4- nitrobenzyl)oxy]phenyl}methylidene]acetohydrazide
Smiles: O=C(CSc1nc2c(s1)cccc2)N/N=C/c1ccccc1OCc1ccc(cc1)[N+](=O)[O-]

STK539385
Synonyms: (2E)- N- (2,4- dichlorophenyl)- 2- [4- (dimethylamino)benzylidene]hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1Cl)Cl)N/N=C/c1ccc(cc1)N(C)C

STK539386
Synonyms: (8S,8aR)- 6- amino- 8- (4- tert- butylphenyl)- 2- propyl- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: CCCN1CC=C2[C@H](C1)[C@@H](c1ccc(cc1)C(C)(C)C)C(C(=C2C#N)N)(C#N)C#N

STK539388
Synonyms: N- benzyl- 2- {[4- (4- methoxyphenyl)- 5- oxo- 7- (propan- 2- yl)- 4,5,6,9- tetrahydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}propanamide
Smiles: COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CC(OCc1s2)C(C)C)SC(C(=O)NCc1ccccc1)C

STK539389
Synonyms: methyl4- (4- methylphenyl)- 2- {[(thiophen- 2- ylacetyl)carbamothioyl]amino}thiophene- 3- carboxylate
Smiles: COC(=O)c1c(scc1c1ccc(cc1)C)NC(=S)NC(=O)Cc1cccs1

STK539390
Synonyms: 2- (2- bromophenyl)- 3- phenylquinazolin- 4(3H)- one
Smiles: Brc1ccccc1c1nc2ccccc2c(=O)n1c1ccccc1

STK539392
Synonyms: N'- [(E)- (2- methoxyphenyl)methylidene]- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)CSc1nnc(n1C)c1ccccc1

STK539393
Synonyms: methyl5- bromo- 3- {[(4- chlorophenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1ccc(cc1)Cl)cc(cc2)Br

STK539394
Synonyms: pentyl{[3- benzyl- 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}acetate
Smiles: CCCCCOC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(OC3)C(C)C

STK539396
Synonyms: methyl2- {[(2- amino- 1- hexyl- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl)carbonyl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCCCCCn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2

STK539397
Synonyms: N- ({2- [(2- phenylquinolin- 4- yl)carbonyl]hydrazinyl}carbonothioyl)furan- 2- carboxamide
Smiles: S=C(NC(=O)c1ccco1)NNC(=O)c1cc(nc2c1cccc2)c1ccccc1

STK539398
Synonyms: 2- ({[(2E)- 3- (3,4- dimethoxyphenyl)prop- 2- enoyl]carbamothioyl}amino)- 4,5,6,7,8,9- hexahydrocycloocta[b]thiophene- 3- carboxamide
Smiles: COc1ccc(cc1OC)/C=C/C(=O)NC(=S)Nc1sc2c(c1C(=O)N)CCCCCC2

STK539399
Synonyms: diethyl(tert- butylamino)(formylamino)propanedioate
Smiles: O=CNC(C(=O)OCC)(C(=O)OCC)NC(C)(C)C

STK539400
Synonyms: 2- [(3- benzyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N- (2- methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3

STK539403
Synonyms: 5- cyano- 6- {[2- (cyclopropylamino)- 2- oxoethyl]sulfanyl}- 2- methyl- N- phenyl- 1,4- dihydro- 4,4'- bipyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)NC2CC2)NC(=C(C1c1ccncc1)C(=O)Nc1ccccc1)C

STK539404
Synonyms: 2- [(4,5- diphenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N'- [(2Z,3E)- 4- phenylbut- 3- en- 2- ylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1c1ccccc1)c1ccccc1)N/N=C(\C=C\c1ccccc1)/C

STK539406
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- phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3

STK539408
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(E)- (3,5- dibromo- 4- hydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnnc1N)N/N=C/c1cc(Br)c(c(c1)Br)O

STK539410
Synonyms: methyl2- ({[2- amino- 1- (3- chlorophenyl)- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl]carbonyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)Cl

STK539412
Synonyms: 2,2,5- trimethyl- 8- (propylsulfanyl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C

STK539413
Synonyms: 3- {[(E)- (3- nitrophenyl)methylidene]amino}- 2- [({[(1E)- 1- phenylethylidene]amino}oxy)methyl]quinazolin- 4(3H)- one
Smiles: C/C(=N\OCc1nc2ccccc2c(=O)n1/N=C/c1cccc(c1)[N+](=O)[O-])/c1ccccc1

STK539414
Synonyms: 2- amino- 4- (2- fluoro- 5- methoxyphenyl)- 5- oxo- 4H,5H- pyrano[3,2- c]chromene- 3- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc(OC)ccc1F)c(=O)oc1c2cccc1

STK539415
Synonyms: 4- benzyl- 1- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CC(=C)CSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CC(OC3)C(C)C

STK539416
Synonyms: 3- (4- {[5- (3,4- dichlorophenyl)furan- 2- yl]carbonothioyl}piperazin- 1- yl)propanenitrile
Smiles: N#CCCN1CCN(CC1)C(=S)c1ccc(o1)c1ccc(c(c1)Cl)Cl

STK539417
Synonyms: 3- {[(E)- (5- bromo- 2- hydroxy- 3- nitrophenyl)methylidene]amino}- 2- methylquinazolin- 4(3H)- one
Smiles: Brc1cc(/C=N/n2c(C)nc3c(c2=O)cccc3)c(c(c1)[N+](=O)[O-])O

STK539418
Synonyms: methylN- [(2,5- dichlorophenyl)carbamoyl]- 3,3,3- trifluoro- 2- (3- fluorophenoxy)alaninate
Smiles: COC(=O)C(C(F)(F)F)(Oc1cccc(c1)F)NC(=O)Nc1cc(Cl)ccc1Cl

STK539419
Synonyms: 3- cyclohexyl- 11- (2- methoxybenzyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccccc1Cn1c2nc3ccccc3nc2c2c1ncn(c2=O)C1CCCCC1

STK539420
Synonyms: 8- {[2- (diethylamino)ethyl]amino}- 7- [2- hydroxy- 3- (4- methoxyphenoxy)propyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCN(CCNc1nc2c(n1CC(COc1ccc(cc1)OC)O)c(=O)n(c(=O)n2C)C)CC

STK539422
Synonyms: 3- benzyl- 2- [(4- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Cc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3

STK539423
Synonyms: 6- [3- acetyl- 4- hydroxy- 2- (4- methylphenyl)- 5- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl]hexanoicacid
Smiles: OC(=O)CCCCCN1C(c2ccc(cc2)C)C(=C(C1=O)O)C(=O)C

STK539424
Synonyms: 5- amino- 2- (3- nitrophenyl)- 1- phenyl- 1,2- dihydro- 3H- pyrrole- 3,3,4- tricarbonitrile
Smiles: N#CC1=C(N)N(C(C1(C#N)C#N)c1cccc(c1)[N+](=O)[O-])c1ccccc1

STK539425
Synonyms: (8S)- 6- amino- 2- ethyl- 8- [3- methoxy- 4- (propan- 2- yloxy)phenyl]- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: CCN1CC=C2C(C1)[C@@H](c1ccc(c(c1)OC)OC(C)C)C(C(=C2C#N)N)(C#N)C#N

STK539426
Synonyms: 1- (3,4- dichlorophenyl)- 3- (2- hydroxy- 2- methylpropyl)urea
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)NCC(O)(C)C

STK539427
Synonyms: ethyl{[3- (2- methoxyphenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2ccccc2c(=O)n1c1ccccc1OC

STK539429
Synonyms: (1R,9R)- 1,9- bis(2- fluorophenyl)- 2,5,8- trimethyl- 2,3,4,5,6,7,8,9- octahydro- 1H- pyrrolo[3,2- c:4,5- c']dipyridine
Smiles: CN1CCc2c([C@@H]1c1ccccc1F)c1c(n2C)CCN([C@H]1c1ccccc1F)C

STK539430
Synonyms: 2- cyclopropyl- N'- [(E)- (3,5- dibromo- 4- hydroxyphenyl)methylidene]quinoline- 4- carbohydrazide
Smiles: Brc1cc(/C=N/NC(=O)c2cc(nc3c2cccc3)C2CC2)cc(c1O)Br

STK539431
Synonyms: (1'R,3R,3'R)- 1'- [(3,4- dimethoxyphenyl)carbonyl]- 3'- (phenylcarbonyl)- 3',3a'- dihydrospiro[indole- 3,2'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: COc1cc(ccc1OC)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccccc1

STK539432
Synonyms: ethyl1- {[(E)- ethoxymethylidene]amino}- 5- (2- methylpropyl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxylate
Smiles: CCOC(=O)c1sc2c(c1/N=C/OCC)c1CCCCc1c(n2)CC(C)C

STK539433
Synonyms: 3- [(2- bromoprop- 2- en- 1- yl)sulfanyl]- 5- (methylsulfanyl)- 10- (propan- 2- yl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=C)Br)nn2)CC(OC3)C(C)C

STK539434
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (2,4- dihydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1ccc(cc1O)O

STK539435
Synonyms: methyl4,5- dimethyl- 2- ({3- [(phenylsulfonyl)amino]quinoxalin- 2- yl}amino)thiophene- 3- carboxylate
Smiles: COC(=O)c1c(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccccc2)sc(c1C)C

STK539437
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- 1,3- benzodioxol- 5- ylmethylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1ccc2c(c1)OCO2

STK539438
Synonyms: 9- (heptylsulfanyl)- 8- phenyl- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCc1c3cccc1

STK539441
Synonyms: 2- cyclopropyl- N'- [(E)- (4- ethoxy- 3- hydroxyphenyl)methylidene]quinoline- 4- carbohydrazide
Smiles: CCOc1ccc(cc1O)/C=N/NC(=O)c1cc(nc2c1cccc2)C1CC1

STK539442
Synonyms: 8- {[2- (dimethylamino)ethyl]amino}- 7- [2- hydroxy- 3- (4- methoxyphenoxy)propyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1ccc(cc1)OCC(Cn1c(NCCN(C)C)nc2c1c(=O)[nH]c(=O)n2C)O

STK539443
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1E,2E)- 3- phenylprop- 2- en- 1- ylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/C=C/c1ccccc1

STK539446
Synonyms: 4,6- dimethyl- 2- phenoxypyridine- 3- carbonitrile
Smiles: N#Cc1c(C)cc(nc1Oc1ccccc1)C

STK539447
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- [4- (2- methoxyphenyl)piperazin- 1- yl]ethanone
Smiles: COc1ccccc1N1CCN(CC1)CC(=O)c1c(C)[nH]c2c1ccc(c2)C

STK539448
Synonyms: N- (3,4- dimethylphenyl)- 2- (8- methoxy- 2- methyl- 4- oxoquinolin- 1(4H)- yl)acetamide
Smiles: COc1cccc2c1n(CC(=O)Nc1ccc(c(c1)C)C)c(cc2=O)C

STK539450
Synonyms: N'- [(E)- pyridin- 3- ylmethylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/c1cccnc1

STK539451
Synonyms: N'- [(E)- (5- bromo- 2,4- dimethoxyphenyl)methylidene]- 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)CSc1nnc(n1C)c1cccc(c1)Br)Br

STK539452
Synonyms: 4,6- dimethyl- 2- {(2E)- 2- [1- (4- methylphenyl)ethylidene]hydrazinyl}pyrimidine
Smiles: Cc1ccc(cc1)/C(=N/Nc1nc(C)cc(n1)C)/C

STK539456
Synonyms: 1- methyl- 4- (3- methylphenyl)- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Cc1cccc(c1)n1c(=O)c2c3CCCc3sc2n2c1nnc2C

STK539458
Synonyms: N- benzyl- 3- chloro- N- [cyano(phenyl)methyl]propanamide
Smiles: ClCCC(=O)N(C(c1ccccc1)C#N)Cc1ccccc1

STK539459
Synonyms: ethyl5- fluoro- 3- ({2- [4- (2- hydroxyethyl)piperazin- 1- yl]propanoyl}amino)- 1H- indole- 2- carboxylate
Smiles: OCCN1CCN(CC1)C(C(=O)Nc1c([nH]c2c1cc(F)cc2)C(=O)OCC)C

STK539460
Synonyms: methyl3- ({[4- (3- chlorophenyl)piperazin- 1- yl]acetyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)Cl)cccc2

STK539461
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (2,4- dichlorophenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1ccc(cc1Cl)Cl

STK539462
Synonyms: 2- cyclopropyl- N'- [(E)- naphthalen- 1- ylmethylidene]quinoline- 4- carbohydrazide
Smiles: O=C(c1cc(nc2c1cccc2)C1CC1)N/N=C/c1cccc2c1cccc2

STK539464
Synonyms: 7- [(3- methoxypropyl)amino]- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: COCCCNc1cc2oc3ccccc3[nH]c2c2c1c(=O)c1ccccc1c2=O

STK539465
Synonyms: 2- (2,6- dichlorophenyl)- 4,5- diphenyl- 1H- imidazole
Smiles: Clc1cccc(c1c1nc(c([nH]1)c1ccccc1)c1ccccc1)Cl

STK539466
Synonyms: 2- (4- chlorophenyl)- 5- (3,4- dimethoxyphenyl)- 7- methoxy- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: COc1cccc2c1OC(c1ccc(c(c1)OC)OC)N1C2CC(=N1)c1ccc(cc1)Cl

STK539467
Synonyms: 2- [4- (prop- 2- en- 1- yloxy)phenyl]- 5- (thiophen- 2- yl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: C=CCOc1ccc(cc1)C1=NN2C(C1)c1ccccc1OC2c1cccs1

STK539469
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- (3- methylpiperidin- 1- yl)ethanone
Smiles: CC1CCCN(C1)CC(=O)c1c(C)[nH]c2c1ccc(c2)C

STK539470
Synonyms: 3- {[(E)- (2,4- dihydroxyphenyl)methylidene]amino}- 2- [(2- methylphenoxy)methyl]quinazolin- 4(3H)- one
Smiles: Oc1ccc(c(c1)O)/C=N/n1c(COc2ccccc2C)nc2c(c1=O)cccc2

STK539472
Synonyms: methyl2- ({[(2E)- 3- (3,4- dimethoxyphenyl)prop- 2- enoyl]carbamothioyl}amino)- 4- (4- methylphenyl)thiophene- 3- carboxylate
Smiles: COC(=O)c1c(scc1c1ccc(cc1)C)NC(=S)NC(=O)/C=C/c1ccc(c(c1)OC)OC

STK539474
Synonyms: 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)- 1- (2- methyl- 1H- indol- 3- yl)ethanone
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)c1c(C)[nH]c2c1cccc2

STK539475
Synonyms: methyl4- [(E)- {2- [(2- methylimidazo[1,2- a]pyridin- 3- yl)carbonyl]hydrazinylidene}methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/NC(=O)c1c(C)nc2n1cccc2

STK539476
Synonyms: 8- chloro- 3- {[(E)- (4- hydroxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Oc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Cl

STK539477
Synonyms: 3- amino- N- (3,5- dimethoxybenzyl)- 6- (thiophen- 2- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cc(CNC(=O)c2sc3c(c2N)ccc(n3)c2cccs2)cc(c1)OC

STK539478
Synonyms: 3- ({(E)- [4- (decyloxy)phenyl]methylidene}amino)- 8- methoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: CCCCCCCCCCOc1ccc(cc1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)OC

STK539479
Synonyms: N'- [(E)- (3- bromo- 4- hydroxy- 5- methoxyphenyl)methylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2ccccn2)cc(c1O)Br

STK539481
Synonyms: 3- ({3- methyl- 2- [(phenylcarbonyl)amino]but- 2- enoyl}amino)benzoicacid
Smiles: CC(=C(C(=O)Nc1cccc(c1)C(=O)O)NC(=O)c1ccccc1)C

STK539482
Synonyms: 3- amino- N- (2,3- dimethylphenyl)- 6- (3- methoxyphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1cccc(c1C)C

STK539483
Synonyms: pentyl{[6,6- dimethyl- 3- (3- methylphenyl)- 4- oxo- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}acetate
Smiles: CCCCCOC(=O)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)(C)C

STK539485
Synonyms: 1- ethyl- 6- fluoro- 4- oxo- N- (pyridin- 4- ylmethyl)- 7- [4- (quinolin- 2- ylcarbonyl)piperazin- 1- yl]- 1,4- dihydroquinoline- 3- carboxamide
Smiles: CCn1cc(C(=O)NCc2ccncc2)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccc3c(n1)cccc3)c(c2)F

STK539486
Synonyms: N'- [(E)- (5- nitrothiophen- 2- yl)methylidene]- 2- [4- (1H- tetrazol- 1- yl)phenoxy]acetohydrazide
Smiles: O=C(COc1ccc(cc1)n1cnnn1)N/N=C/c1ccc(s1)[N+](=O)[O-]

STK539488
Synonyms: N'- [(2E,3E)- 4- phenylbut- 3- en- 2- ylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C(/C=C/c1ccccc1)\C

STK539489
Synonyms: 2,2,5- trimethyl- 8- [(2- phenylethyl)sulfanyl]- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: Cc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCCc1ccccc1

STK539490
Synonyms: 2- [(E)- (4- bromophenyl)diazenyl]- 2- [3,4- dihydro- 2H- pyran- 5- yl(diphenyl)- lambda~5~- phosphanylidene]- 1- phenylethanone
Smiles: Brc1ccc(cc1)/N=N/C(=P(c1ccccc1)(c1ccccc1)C1=COCCC1)C(=O)c1ccccc1

STK539491
Synonyms: ethyl6- tert- butyl- 1,4- diphenyl- 1,4- dihydro- 1,2,4- diazaphosphinine- 3- carboxylate4- sulfide
Smiles: CCOC(=O)C1=NN(c2ccccc2)C(=CP1(=S)c1ccccc1)C(C)(C)C

STK539492
Synonyms: [3- amino- 4- (4- chlorophenyl)- 6,7- dihydro- 5H- cyclopenta[b]thieno[3,2- e]pyridin- 2- yl](3- methoxyphenyl)methanone
Smiles: COc1cccc(c1)C(=O)c1sc2c(c1N)c(c1ccc(cc1)Cl)c1c(n2)CCC1

STK539493
Synonyms: 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N'- [(E)- pyridin- 3- ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1cccnc1

STK539494
Synonyms: 3- bromo- N- (5- chloropyridin- 2- yl)- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: Clc1ccc(nc1)NC(=O)c1coc(=O)c(c1)Br

STK539496
Synonyms: (1S)- N- (4- fluorophenyl)- 6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinoline- 2(1H)- carbothioamide
Smiles: COc1cc2c(cc1OC)CCN([C@H]2C)C(=S)Nc1ccc(cc1)F

STK539497
Synonyms: 2- (heptylsulfanyl)- 6,6- dimethyl- 3- (3- methylphenyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)(C)C

STK539498
Synonyms: 2,2,3,3,4,4,5,5,5- nonafluoro- N- (3- methylpyridin- 2- yl)pentanamide
Smiles: O=C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)Nc1ncccc1C

STK539499
Synonyms: N'- [(E)- 1H- indol- 2- ylmethylidene]furan- 2- carbohydrazide
Smiles: O=C(c1ccco1)N/N=C/c1cc2c([nH]1)cccc2

STK539500
Synonyms: 2,2,3,3,4,4,4- heptafluoro- N- [4- (naphthalen- 1- yl)- 1,3- thiazol- 2- yl]butanamide
Smiles: O=C(C(C(C(F)(F)F)(F)F)(F)F)Nc1scc(n1)c1cccc2c1cccc2

STK539501
Synonyms: 4- [(1,3- dioxo- 1,3- dihydro- 2H- inden- 2- ylidene)methyl]phenyl2- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)propanoate
Smiles: O=C(C(N1C(=O)c2c(C1=O)cccc2)C)Oc1ccc(cc1)/C=C/1\C(=O)c2c(C1=O)cccc2

STK539502
Synonyms: 2- ({3- [4- (diphenylmethyl)piperazin- 1- yl]quinoxalin- 2- yl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: N#Cc1c(Nc2nc3ccccc3nc2N2CCN(CC2)C(c2ccccc2)c2ccccc2)sc2c1CCCC2

STK539503
Synonyms: 3- amino- N- (2,4- dichlorophenyl)- 6- (3- methoxyphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1ccc(cc1Cl)Cl

STK539504
Synonyms: ethyl(2Z)- 5- (3- methoxyphenyl)- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 7- phenyl- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)C1=C(N=c2n(C1c1cccc(c1)OC)c(=O)/c(=C/c1cn(c3c1cccc3)C)/s2)c1ccccc1

STK539505
Synonyms: (6aS,6bR,9aS,10R)- 10- [(4- bromophenyl)carbonyl]- 3- chloro- 8- (naphthalen- 1- yl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1cccc3c1cccc3)C=Cc1c2ccc(c1)Cl

STK539507
Synonyms: 9- (3- {[4- (2- fluorophenyl)piperazin- 1- yl]methyl}- 4- methoxyphenyl)- 3,3,6,6- tetramethyl- 3,4,5,6,7,9- hexahydro- 1H- xanthene- 1,8(2H)- dione
Smiles: COc1ccc(cc1CN1CCN(CC1)c1ccccc1F)C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C

STK539508
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- (4- methylpiperidin- 1- yl)ethanone
Smiles: CC1CCN(CC1)CC(=O)c1c(C)[nH]c2c1ccc(c2)C

STK539509
Synonyms: (1'R,3R,3'R)- 1'- [(4- bromophenyl)carbonyl]- 3'- (pyridin- 3- ylcarbonyl)- 3',3a'- dihydrospiro[indole- 3,2'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccnc1

STK539510
Synonyms: 8- [(2- bromoprop- 2- en- 1- yl)sulfanyl]- 5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: BrC(=C)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK539511
Synonyms: 2- (azepan- 1- yl)- N'- [(E)- (4- methoxy- 3- nitrophenyl)methylidene]- 2- oxoacetohydrazide
Smiles: COc1ccc(cc1[N+](=O)[O-])/C=N/NC(=O)C(=O)N1CCCCCC1

STK539512
Synonyms: 2- [(2,4- dichlorobenzyl)sulfanyl]- 7,7- dimethyl- 5- oxo- 5,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: N#Cc1cc2C(=O)CC(Cc2nc1SCc1ccc(cc1Cl)Cl)(C)C

STK539513
Synonyms: 2- methyl- N'- [(E)- (6- methylpyridin- 2- yl)methylidene]quinoline- 4- carbohydrazide
Smiles: Cc1cccc(n1)/C=N/NC(=O)c1cc(C)nc2c1cccc2

STK539514
Synonyms: ethyl{[4- benzyl- 5- oxo- 7- (propan- 2- yl)- 4,5,6,9- tetrahydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CC(OC3)C(C)C

STK539515
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- 1H- indol- 3- ylmethylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1c[nH]c2c1cccc2

STK539518
Synonyms: methyl2- ({[(4- chlorophenyl)acetyl]carbamothioyl}amino)- 4,5,6,7,8,9,10,11,12,13- decahydrocyclododeca[b]thiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC(=S)NC(=O)Cc2ccc(cc2)Cl)sc2c1CCCCCCCCCC2

STK539519
Synonyms: methyl1- (1,3- benzodioxol- 5- ylmethyl)- 6- oxo- 1,6- dihydropyridine- 3- carboxylate
Smiles: COC(=O)c1ccc(=O)n(c1)Cc1ccc2c(c1)OCO2

STK539520
Synonyms: 8- [(2- aminoethyl)amino]- 7- (4- fluorobenzyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: NCCNc1nc2c(n1Cc1ccc(cc1)F)c(=O)n(c(=O)n2C)C

STK539521
Synonyms: (8S,8aR)- 6- amino- 8- [2- (trifluoromethyl)phenyl]- 8,8a- dihydro- 1H- isochromene- 5,7,7(3H)- tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCOC2)c1ccccc1C(F)(F)F)(C#N)C#N

STK539522
Synonyms: 8- [(2E)- 2- (5- bromo- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)hydrazinyl]- 1,3- dimethyl- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(N/N=C\2/C(=O)Nc3c2cc(Br)cc3)nc2c1c(=O)n(c(=O)n2C)C

STK539523
Synonyms: N'- [(1E)- 1- (4- bromophenyl)ethylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C(/c1ccc(cc1)Br)\C

STK539524
Synonyms: 8- [(4- fluorobenzyl)sulfanyl]- 1,3- dimethyl- 7- (3- phenylpropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccc(cc1)CSc1nc2c(n1CCCc1ccccc1)c(=O)n(c(=O)n2C)C

STK539525
Synonyms: 2- {[3- benzyl- 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- phenylpropanamide
Smiles: O=C(C(Sc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(OC3)C(C)C)C)Nc1ccccc1

STK539527
Synonyms: 8- benzyl- 9- (hexylsulfanyl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CCCCCCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCc1c3cccc1

STK539528
Synonyms: methyl2- ({[2- amino- 1- (4- fluorobenzyl)- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl]carbonyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc(cc1)F

STK539529
Synonyms: N'- [(E)- (4- ethoxy- 3- hydroxyphenyl)methylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: CCOc1ccc(cc1O)/C=N/NC(=O)Cn1cncn1

STK539530
Synonyms: (6aS,6bR,9aS,10R)- 8- (4- fluorophenyl)- 10- [(4- methoxyphenyl)carbonyl]- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)F)C=Cc1c2cccc1

STK539531
Synonyms: 8- (hexylsulfanyl)- 2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CCCCCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C

STK539532
Synonyms: N- (5,6- dimethylthieno[2,3- d]pyrimidin- 4- yl)glycine
Smiles: Cc1c(C)sc2c1c(NCC(=O)O)ncn2

STK539533
Synonyms: 3- {[(E)- (4- bromophenyl)methylidene]amino}- 2- (phenoxymethyl)quinazolin- 4(3H)- one
Smiles: Brc1ccc(cc1)/C=N/n1c(COc2ccccc2)nc2c(c1=O)cccc2

STK539534
Synonyms: 3- (4- methoxyphenyl)- 2- pentylquinazolin- 4(3H)- one
Smiles: CCCCCc1nc2ccccc2c(=O)n1c1ccc(cc1)OC

STK539535
Synonyms: 5- (morpholin- 4- yl)- 8- (propylsulfanyl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: CCCSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK539536
Synonyms: 7- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- N- [1- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)ethyl]heptanamide
Smiles: O=C(NC(C12CC3CC(C2)CC(C1)C3)C)CCCCCCN1C(=O)c2c(C1=O)cccc2

STK539537
Synonyms: (2E)- 3- (4- methoxyphenyl)- N- [1- (phenylcarbonyl)- 1,2,3,4- tetrahydroquinolin- 6- yl]prop- 2- enamide
Smiles: COc1ccc(cc1)/C=C/C(=O)Nc1ccc2c(c1)CCCN2C(=O)c1ccccc1

STK539539
Synonyms: ethyl{[11- (2- methylpropyl)- 7,8,9,10- tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 3- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)CC(C)C

STK539541
Synonyms: N'- [(E)- (4- chlorophenyl)methylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1ncnc1)N/N=C/c1ccc(cc1)Cl

STK539542
Synonyms: 2- (4- methoxyphenyl)- 9- nitro- 5- phenyl- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: COc1ccc(cc1)C1=NN2C(C1)c1cc(ccc1OC2c1ccccc1)[N+](=O)[O-]

STK539543
Synonyms: {4- [(4- chlorophenyl)sulfonyl]phenyl}(8- cyclohexyl- 1,2,3a,4,5,6- hexahydro- 3H- pyrazino[3,2,1- jk]carbazol- 3- yl)methanone
Smiles: Clc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(=O)N1CCn2c3C1CCCc3c1c2ccc(c1)C1CCCCC1

STK539544
Synonyms: 7,9- dibromo- 5- (4- chlorophenyl)- 2- (4- methoxyphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: COc1ccc(cc1)C1=NN2C(C1)c1cc(Br)cc(c1OC2c1ccc(cc1)Cl)Br

STK539545
Synonyms: methyl2- ({3- [4- (4- fluorophenyl)piperazin- 1- yl]quinoxalin- 2- yl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(Nc2nc3ccccc3nc2N2CCN(CC2)c2ccc(cc2)F)sc2c1CCCC2

STK539546
Synonyms: 4- (4- methylphenyl)- 1- [(2- phenylethyl)sulfanyl]- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CC(C1OCc2c(C1)c1c(s2)n2c(SCCc3ccccc3)nnc2n(c1=O)c1ccc(cc1)C)C

STK539548
Synonyms: methyl(1R,2R,3R,8aS)- 6- acetyl- 3- carbamoyl- 1- cyano- 2- (3,4,5- trimethoxyphenyl)- 1,2,3,8a- tetrahydroindolizine- 1- carboxylate
Smiles: COC(=O)[C@@]1(C#N)[C@@H]2C=CC(=CN2[C@H]([C@@H]1c1cc(OC)c(c(c1)OC)OC)C(=O)N)C(=O)C

STK539550
Synonyms: 1- (2- hydroxyethyl)- 2- imino- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carbonitrile
Smiles: OCCn1c(=N)c(C#N)cc2c1nc1ccccn1c2=O

STK539552
Synonyms: 8,8- dimethyl- 11- phenyl- 7,10- dihydro- 8H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[2,3- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CC1(C)OCc2c(C1)c1c(nc2c2ccccc2)sc2c1ncn1c2nnc1

STK539553
Synonyms: 3- {[(E)- (3- chlorophenyl)methylidene]amino}- 8- methoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1cccc(c1)Cl

STK539554
Synonyms: 2- (1,3- benzothiazol- 2- ylsulfanyl)- N'- {(E)- [3- methoxy- 4- (propan- 2- yloxy)phenyl]methylidene}acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nc3c(s2)cccc3)ccc1OC(C)C

STK539555
Synonyms: 3- amino- N- (2- ethoxyphenyl)- 6- (3- methoxyphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: CCOc1ccccc1NC(=O)c1sc2c(c1N)ccc(n2)c1cccc(c1)OC

STK539556
Synonyms: 8- [(4- chlorobenzyl)sulfanyl]- 7- hexyl- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCn1c(SCc2ccc(cc2)Cl)nc2c1c(=O)n(c(=O)n2C)C

STK539557
Synonyms: (1'R,3R,3'R)- 3'- [(3,4- dimethoxyphenyl)carbonyl]- 1'- [(4- methoxyphenyl)carbonyl]- 3',3a'- dihydrospiro[indole- 3,2'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(c(c1)OC)OC

STK539558
Synonyms: (8R,8aR)- 6- amino- 8- (2,5- dimethoxyphenyl)- 2- ethyl- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: CCN1CC=C2[C@H](C1)[C@@H](c1cc(OC)ccc1OC)C(C(=C2C#N)N)(C#N)C#N

STK539559
Synonyms: (2E)- 2- [(5- nitrothiophen- 2- yl)methylidene]- N- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)hydrazinecarboxamide
Smiles: O=C(NC12CC3CC(C2)CC(C1)C3)N/N=C/c1ccc(s1)[N+](=O)[O-]

STK539561
Synonyms: (5Z)- 5- [5- chloro- 2- (naphthalen- 1- ylmethoxy)benzylidene]- 3- (4- ethoxyphenyl)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCOc1ccc(cc1)N1C(=S)S/C(=C\c2cc(Cl)ccc2OCc2cccc3c2cccc3)/C1=O

STK539562
Synonyms: N'- [(E)- (2- hydroxy- 5- nitrophenyl)methylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1cncn1)N/N=C/c1cc(ccc1O)[N+](=O)[O-]

STK539564
Synonyms: 8- chloro- 3- {[(E)- (2,5- dimethoxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc(cc1/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Cl)OC

STK539565
Synonyms: 8- [(2E)- 2- (4- chlorobenzylidene)hydrazinyl]- 1,3- dimethyl- 7- (4- methylbenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1ccc(cc1)Cn1c(N/N=C/c2ccc(cc2)Cl)nc2c1c(=O)n(c(=O)n2C)C

STK539566
Synonyms: N'- [(E)- (4- bromophenyl)methylidene]- 6- oxo- 1,6- dihydropyridazine- 3- carbohydrazide
Smiles: Brc1ccc(cc1)/C=N/NC(=O)c1ccc(=O)[nH]n1

STK539567
Synonyms: 2- {4- [(E)- {2- [(2- cyclopropylquinolin- 4- yl)carbonyl]hydrazinylidene}methyl]- 2- methoxyphenoxy}acetamide
Smiles: COc1cc(/C=N/NC(=O)c2cc(nc3c2cccc3)C2CC2)ccc1OCC(=O)N

STK539568
Synonyms: 11- (3- bromophenyl)- 10- methyl- N- (4- methylphenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Brc1cccc(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1)C)c1ccccc1

STK539569
Synonyms: 3- amino- N- (3,4- dimethoxyphenyl)- 6- (3- methoxyphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1ccc(c(c1)OC)OC

STK539570
Synonyms: 2- amino- N- (3- ethoxypropyl)- 1- (4- methoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCOCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)OC

STK539571
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- [(3R)- 4- (4- methoxyphenyl)- 3- methylpiperazin- 1- yl]ethanone
Smiles: COc1ccc(cc1)N1CCN(CC1C)CC(=O)c1c(C)[nH]c2c1ccc(c2)C

STK539572
Synonyms: ethyl2- (4- bromophenyl)- 4- hydroxy- 1- (4- nitrophenyl)- 5- oxo- 2,5- dihydro- 1H- pyrrole- 3- carboxylate
Smiles: CCOC(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)Br)c1ccc(cc1)[N+](=O)[O-]

STK539573
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 3- (4- methylphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Cc1ccc(cc1)n1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK539574
Synonyms: (9E)- 9- (2- chlorobenzylidene)- 5- (2- chlorophenyl)- 3- (4- chlorophenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: Clc1ccc(cc1)c1csc2=NC3=C(C(n12)c1ccccc1Cl)CCC/C/3=C\c1ccccc1Cl

STK539575
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1E,2E)- 3- phenylprop- 2- en- 1- ylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/C=C/c1ccccc1

STK539576
Synonyms: 7,9- dichloro- 5- (4- methoxyphenyl)- 2- phenyl- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: COc1ccc(cc1)C1Oc2c(Cl)cc(cc2C2N1N=C(C2)c1ccccc1)Cl

STK539577
Synonyms: 2- [4- (5- chloro- 2- methylphenyl)piperazin- 1- yl]- 1- (2- methyl- 1H- indol- 3- yl)ethanone
Smiles: Clc1ccc(c(c1)N1CCN(CC1)CC(=O)c1c(C)[nH]c2c1cccc2)C

STK539578
Synonyms: ethyl(2- bromo- 1- hydroxy- 1- phenylethyl)ethenylphosphinate
Smiles: BrCC(P(=O)(OCC)C=C)(c1ccccc1)O

STK539579
Synonyms: 2- {3- [2- (3,4- dimethoxyphenyl)ethyl]- 1- (4- methoxyphenyl)- 5- oxo- 2- thioxoimidazolidin- 4- yl}- N- (4- propoxyphenyl)acetamide
Smiles: CCCOc1ccc(cc1)NC(=O)CC1N(CCc2ccc(c(c2)OC)OC)C(=S)N(C1=O)c1ccc(cc1)OC

STK539580
Synonyms: tert- butyl(8S,8aR)- 6- amino- 5,7,7- tricyano- 8- (3- ethoxy- 4- propoxyphenyl)- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCCOc1ccc(cc1OCC)[C@@H]1[C@H]2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(=O)OC(C)(C)C

STK539582
Synonyms: (2E)- N- (2,4- dichlorophenyl)- 2- (3- hydroxybenzylidene)hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1Cl)Cl)N/N=C/c1cccc(c1)O

STK539583
Synonyms: 3- amino- N- (2,4- dimethylphenyl)- 6- (3- methoxyphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1ccc(cc1C)C

STK539584
Synonyms: N'- [(E)- (5- bromo- 2- hydroxyphenyl)methylidene]- 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1cc(Br)ccc1O

STK539588
Synonyms: methyl5- bromo- 3- {[(2- nitrophenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1ccccc1[N+](=O)[O-])cc(cc2)Br

STK539589
Synonyms: methyl5- chloro- 3- [(phenoxycarbonyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)Oc1ccccc1)cc(cc2)Cl

STK539590
Synonyms: 2- {[2,2- dimethyl- 5- (morpholin- 4- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- yl]sulfanyl}- N- (2- nitrophenyl)acetamide
Smiles: O=C(Nc1ccccc1[N+](=O)[O-])CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK539591
Synonyms: 2- cyclopropyl- N'- [(E)- (2- hydroxy- 3- methoxy- 5- nitrophenyl)methylidene]quinoline- 4- carbohydrazide
Smiles: COc1cc(cc(c1O)/C=N/NC(=O)c1cc(nc2c1cccc2)C1CC1)[N+](=O)[O-]

STK539594
Synonyms: 6- chloro- 2- methyl- 3- [(2- methylpiperidin- 1- yl)methyl]quinolin- 4- ol
Smiles: Clc1ccc2c(c1)c(O)c(c(n2)C)CN1CCCCC1C

STK539595
Synonyms: ethyl2- ({[(2E)- 3- (3,4- dimethoxyphenyl)prop- 2- enoyl]carbamothioyl}amino)- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)/C=C/c2ccc(c(c2)OC)OC)sc2c1CCCCC2

STK539596
Synonyms: (1'R,3R,3'R)- 1'- [(4- bromophenyl)carbonyl]- 7'- chloro- 3'- [(4- methoxyphenyl)carbonyl]- 3',3a'- dihydrospiro[indole- 3,2'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: COc1ccc(cc1)C(=O)[C@H]1C2C=Cc3c(N2[C@H]([C@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)Br)ccc(c3)Cl

STK539597
Synonyms: (6aR,6bS,9aR,10S)- 10- acetyl- 8- (4- bromophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Brc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)C

STK539598
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1E)- 1- (2,4- dimethoxyphenyl)ethylidene]acetohydrazide
Smiles: COc1cc(OC)ccc1/C(=N/NC(=O)CSc1nnc(n1C)c1ccc(cc1)Cl)/C

STK539599
Synonyms: 2,7- bis[(dimethylamino)methyl]- 1,8- diphenyloctane- 1,8- dione
Smiles: CN(CC(C(=O)c1ccccc1)CCCCC(C(=O)c1ccccc1)CN(C)C)C

STK539600
Synonyms: methyl5- fluoro- 3- {[(2- nitrophenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1ccccc1[N+](=O)[O-])cc(cc2)F

STK539602
Synonyms: 2- amino- 1- (4- chlorophenyl)- N- (3,4- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Clc1ccc(cc1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)Nc1ccc(c(c1)C)C

STK539604
Synonyms: 1- (1,1,1,3,3,3- hexafluoropropan- 2- yl)- 3- (2- methoxyethyl)urea
Smiles: COCCNC(=O)NC(C(F)(F)F)C(F)(F)F

STK539605
Synonyms: 2,2,3,3,4,4,5,5,6,6,7,7,7- tridecafluoro- N- (2- fluorophenyl)heptanamide
Smiles: O=C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Nc1ccccc1F

STK539606
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (4- nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1ccc(cc1)[N+](=O)[O-]

STK539607
Synonyms: N'- cyclohexylidene- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: O=C(NN=C1CCCCC1)CSc1nnc(n1C)c1ccccc1

STK539609
Synonyms: [3- amino- 4,6- di(thiophen- 2- yl)thieno[2,3- b]pyridin- 2- yl](4- fluorophenyl)methanone
Smiles: Fc1ccc(cc1)C(=O)c1sc2c(c1N)c(cc(n2)c1cccs1)c1cccs1

STK539611
Synonyms: N'- [(E)- (6- methylpyridin- 2- yl)methylidene]- 2- phenylquinoline- 4- carbohydrazide
Smiles: Cc1cccc(n1)/C=N/NC(=O)c1cc(nc2c1cccc2)c1ccccc1

STK539612
Synonyms: 3- {[(E)- (4- chlorophenyl)methylidene]amino}- 2- [({[(1E)- 1- phenylethylidene]amino}oxy)methyl]quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)/C=N/n1c(CO/N=C(/c2ccccc2)\C)nc2c(c1=O)cccc2

STK539614
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(2E,3E)- 4- phenylbut- 3- en- 2- ylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C(/C=C/c1ccccc1)\C

STK539615
Synonyms: 3- (3- methylphenyl)- 2- (pentylsulfanyl)quinazolin- 4(3H)- one
Smiles: CCCCCSc1nc2ccccc2c(=O)n1c1cccc(c1)C

STK539616
Synonyms: 8- {(2Z)- 2- [1- (4- methoxyphenyl)ethylidene]hydrazinyl}- 1,3- dimethyl- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(N/N=C(\c2ccc(cc2)OC)/C)nc2c1c(=O)n(c(=O)n2C)C

STK539618
Synonyms: thiophen- 2- yl4- (1H- benzimidazol- 2- yl)butanoate
Smiles: O=C(Oc1cccs1)CCCc1nc2c([nH]1)cccc2

STK539619
Synonyms: methyl2- [(cyclohexylcarbamoyl)amino]- 4,5- dimethoxybenzoate
Smiles: COC(=O)c1cc(OC)c(cc1NC(=O)NC1CCCCC1)OC

STK539620
Synonyms: 2- {[3- (furan- 2- ylmethyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N- (4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3

STK539621
Synonyms: methyl5- methyl- 3- {[(2- nitrophenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1ccccc1[N+](=O)[O-])cc(cc2)C

STK539622
Synonyms: N'- [1- (4- methylphenyl)- 1H- pyrazolo[3,4- d]pyrimidin- 4- yl]- 2- phenylacetohydrazide
Smiles: O=C(Cc1ccccc1)NNc1ncnc2c1cnn2c1ccc(cc1)C

STK539623
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (3- chlorophenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1cccc(c1)Cl

STK539624
Synonyms: (9E)- 9- (4- fluorobenzylidene)- 5- (4- fluorophenyl)- 3- (3- nitrophenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: Fc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1cccc(c1)[N+](=O)[O-])/C(=C/c1ccc(cc1)F)/CCC2

STK539626
Synonyms: N'- [(E)- (5- bromo- 2- methoxyphenyl)methylidene]- 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1/C=N/NC(=O)CSc1nnc(n1C)c1cccc(c1)Br)Br

STK539628
Synonyms: 3- amino- 6- (3- methoxyphenyl)- N- [3- (trifluoromethyl)benzyl]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)NCc1cccc(c1)C(F)(F)F

STK539629
Synonyms: N'- [(E)- (5- bromo- 2,4- dimethoxyphenyl)methylidene]- 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)CSc1nnc(n1C)c1ccc(cc1)Cl)Br

STK539630
Synonyms: (5E)- 2- [4- (3- chloro- 4- methylphenyl)piperazin- 1- yl]- 5- [4- (prop- 2- en- 1- yloxy)benzylidene]- 1,3- thiazol- 4(5H)- one
Smiles: C=CCOc1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccc(c(c1)Cl)C

STK539631
Synonyms: 1- phenyl- 2- {[11- (propan- 2- yl)- 7,8,9,10- tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 3- yl]sulfanyl}ethanone
Smiles: O=C(c1ccccc1)CSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)C(C)C

STK539632
Synonyms: N'- {(E)- [3- methoxy- 4- (propan- 2- yloxy)phenyl]methylidene}- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cn2cncn2)ccc1OC(C)C

STK539633
Synonyms: N'- [(Z)- (4- chlorophenyl)methylidene]- 2- (8- methyl- 1,2,3a,4,5,6- hexahydro- 3H- pyrazino[3,2,1- jk]carbazol- 3- yl)acetohydrazide
Smiles: O=C(CN1CCn2c3C1CCCc3c1c2ccc(c1)C)N/N=C\c1ccc(cc1)Cl

STK539635
Synonyms: 2,2,3,3,4,4,5,5,6,6,7,7,7- tridecafluoro- N- [3- (trifluoromethyl)phenyl]heptanamide
Smiles: O=C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Nc1cccc(c1)C(F)(F)F

STK539636
Synonyms: N'- [(E)- (4- fluorophenyl)methylidene]- 2- (8- methyl- 1,2,3a,4,5,6- hexahydro- 3H- pyrazino[3,2,1- jk]carbazol- 3- yl)acetohydrazide
Smiles: O=C(CN1CCn2c3C1CCCc3c1c2ccc(c1)C)N/N=C/c1ccc(cc1)F

STK539637
Synonyms: (5E)- 2- [4- (3- chloro- 4- methylphenyl)piperazin- 1- yl]- 5- [2- (propan- 2- yloxy)benzylidene]- 1,3- thiazol- 4(5H)- one
Smiles: CC(Oc1ccccc1/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccc(c(c1)Cl)C)C

STK539640
Synonyms: 2- (1H- benzimidazol- 2- yl)- N'- [(E)- 1H- indol- 2- ylmethylidene]acetohydrazide
Smiles: O=C(Cc1[nH]c2c(n1)cccc2)N/N=C/c1[nH]c2c(c1)cccc2

STK539641
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- {4- [(3,4- dichlorobenzyl)oxy]- 3- methoxyphenyl}methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2C)c2cccc(c2)Br)ccc1OCc1ccc(c(c1)Cl)Cl

STK539642
Synonyms: 2- (1,3- benzothiazol- 2- ylsulfanyl)- N'- [(1Z)- 1- (2,4- dimethoxyphenyl)ethylidene]acetohydrazide
Smiles: COc1ccc(c(c1)OC)/C(=N\NC(=O)CSc1nc2c(s1)cccc2)/C

STK539643
Synonyms: 1- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 4- (4- methoxyphenyl)- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CC(OCc1s2)C(C)C)SCC(=O)c1ccc(cc1)Cl

STK539644
Synonyms: 2- (3,5- dimethylpiperidin- 1- yl)- 1- (2- methyl- 1H- indol- 3- yl)ethanone
Smiles: CC1CN(CC(C1)C)CC(=O)c1c(C)[nH]c2c1cccc2

STK539645
Synonyms: 5,5'- sulfanediylbis[3- (3,4- dimethoxyphenyl)- 2,1- benzoxazole]
Smiles: COc1cc(ccc1OC)c1onc2c1cc(cc2)Sc1ccc2c(c1)c(on2)c1ccc(c(c1)OC)OC

STK539646
Synonyms: 3- {[(E)- (1- hydroxynaphthalen- 2- yl)methylidene]amino}- 2- methylquinazolin- 4(3H)- one
Smiles: Oc1c(ccc2c1cccc2)/C=N/n1c(C)nc2c(c1=O)cccc2

STK539647
Synonyms: 1- (hexylsulfanyl)- 4- (4- methoxyphenyl)- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)OC)CC(OC3)C(C)C

STK539648
Synonyms: N'- [(E)- (4- bromophenyl)methylidene]- 2- methylquinoline- 4- carbohydrazide
Smiles: Brc1ccc(cc1)/C=N/NC(=O)c1cc(C)nc2c1cccc2

STK539649
Synonyms: (8S,8aR)- 6- amino- 8- (4- methoxynaphthalen- 1- yl)- 2- propyl- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: CCCN1CC=C2[C@H](C1)[C@@H](c1ccc(c3c1cccc3)OC)C(C(=C2C#N)N)(C#N)C#N

STK539650
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(1E)- 1- phenylbutylidene]acetohydrazide
Smiles: CCC/C(=N\NC(=O)Cn1nnnc1N)/c1ccccc1

STK539651
Synonyms: N'- [(E)- (3- chlorophenyl)methylidene]- 2- cyclopropylquinoline- 4- carbohydrazide
Smiles: Clc1cccc(c1)/C=N/NC(=O)c1cc(nc2c1cccc2)C1CC1

STK539652
Synonyms: 2- [(4,5- diphenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N'- [(1E)- 1- phenylpropylidene]acetohydrazide
Smiles: CC/C(=N\NC(=O)CSc1nnc(n1c1ccccc1)c1ccccc1)/c1ccccc1

STK539653
Synonyms: 2- [4- (2,3- dimethylphenyl)piperazin- 1- yl]- 1- (8- methyl- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)ethanone
Smiles: Cc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)CN1CCN(CC1)c1cccc(c1C)C

STK539654
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (4- ethoxy- 3- hydroxyphenyl)methylidene]acetohydrazide
Smiles: CCOc1ccc(cc1O)/C=N/NC(=O)CSc1nnc(n1C)c1cccc(c1)Br

STK539655
Synonyms: methyl2- [({[3- (2,6- dichlorophenyl)- 5- methyl- 1,2- oxazol- 4- yl]carbonyl}carbamothioyl)amino]- 4- (4- methylphenyl)thiophene- 3- carboxylate
Smiles: COC(=O)c1c(scc1c1ccc(cc1)C)NC(=S)NC(=O)c1c(C)onc1c1c(Cl)cccc1Cl

STK539656
Synonyms: 8- chloro- 3- {[(1E,2E)- 2- methyl- 3- phenylprop- 2- en- 1- ylidene]amino}- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: C/C(=C\c1ccccc1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)Cl

STK539657
Synonyms: 2- (2- bromophenyl)- 3- (3- nitrophenyl)quinazolin- 4(3H)- one
Smiles: Brc1ccccc1c1nc2ccccc2c(=O)n1c1cccc(c1)[N+](=O)[O-]

STK539658
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (2- chlorophenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1ccccc1Cl

STK539659
Synonyms: N'- [(E)- (3- bromophenyl)methylidene]- 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1cccc(c1)Br

STK539660
Synonyms: 4- hydroxy- N'- [(2Z)- 1,1,1- trifluoro- 4- oxo- 4- (thiophen- 2- yl)butan- 2- ylidene]benzohydrazide
Smiles: Oc1ccc(cc1)C(=O)N/N=C(\C(F)(F)F)/CC(=O)c1cccs1

STK539661
Synonyms: 4- chloro- N- {2- [(6,7- dimethoxyisoquinolin- 1- yl)methyl]- 4,5- dimethoxyphenyl}benzenesulfonamide
Smiles: COc1cc(Cc2nccc3c2cc(OC)c(c3)OC)c(cc1OC)NS(=O)(=O)c1ccc(cc1)Cl

STK539664
Synonyms: 3- benzyl- 2- [(3,4- dichlorobenzyl)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)Cc1ccccc1)SCc1ccc(c(c1)Cl)Cl)C

STK539666
Synonyms: N'- [(E)- 1,3- benzodioxol- 5- ylmethylidene]- 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1ccc2c(c1)OCO2

STK539669
Synonyms: 1,3- dimethyl- 7- (4- methylbenzyl)- 8- {(2Z)- 2- [1- (4- nitrophenyl)ethylidene]hydrazinyl}- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1ccc(cc1)Cn1c(N/N=C(\c2ccc(cc2)[N+](=O)[O-])/C)nc2c1c(=O)n(c(=O)n2C)C

STK539670
Synonyms: (6aR,6bS,9aR,10S)- 8- (2,4- dimethylphenyl)- 10- (phenylcarbonyl)- 9a,10- dihydro- 6aH- benzo[f]pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1ccc1c2cccc1)C(=O)c1ccccc1

STK539672
Synonyms: 3- ({(E)- [4- (decyloxy)phenyl]methylidene}amino)- 7,8- dimethoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: CCCCCCCCCCOc1ccc(cc1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(c(c1)OC)OC

STK539673
Synonyms: 4- (4- methoxyphenyl)- 1- {[1- oxo- 1- (piperidin- 1- yl)propan- 2- yl]sulfanyl}- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CC(OCc1s2)C(C)C)SC(C(=O)N1CCCCC1)C

STK539674
Synonyms: ethyl4- [3- acetyl- 4- hydroxy- 2- (4- hydroxy- 3- methoxyphenyl)- 5- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C(=C(C1c1ccc(c(c1)OC)O)C(=O)C)O

STK539676
Synonyms: (6aR,6bS,9aR,10S)- 10- acetyl- 8- (3,5- dichlorophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Clc1cc(Cl)cc(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)C

STK539677
Synonyms: 3- {[(E)- (2- hydroxynaphthalen- 1- yl)methylidene]amino}- 2- [({[(1E)- 1- phenylethylidene]amino}oxy)methyl]quinazolin- 4(3H)- one
Smiles: C/C(=N\OCc1nc2ccccc2c(=O)n1/N=C/c1c(O)ccc2c1cccc2)/c1ccccc1

STK539678
Synonyms: 3- chloro- N- [cyano(phenyl)methyl]- N- (4- methoxyphenyl)propanamide
Smiles: ClCCC(=O)N(C(c1ccccc1)C#N)c1ccc(cc1)OC

STK539680
Synonyms: N'- [(1E,2E)- 3- phenylprop- 2- en- 1- ylidene]- 2- [4- (1H- tetrazol- 1- yl)phenoxy]acetohydrazide
Smiles: O=C(COc1ccc(cc1)n1cnnn1)N/N=C/C=C/c1ccccc1

STK539681
Synonyms: ethyl5- cyano- 4- [4- (methoxycarbonyl)phenyl]- 6- {[2- (4- methoxyphenyl)- 2- oxoethyl]sulfanyl}- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)C(=O)OC)C#N)SCC(=O)c1ccc(cc1)OC

STK539682
Synonyms: (5E)- 2- [4- (2- nitrophenyl)piperazin- 1- yl]- 5- (2- propoxybenzylidene)- 1,3- thiazol- 4(5H)- one
Smiles: CCCOc1ccccc1/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccccc1[N+](=O)[O-]

STK539683
Synonyms: (8R,8aR)- 6- amino- 8- (2,5- dimethoxyphenyl)- 2- methyl- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)C)c1cc(OC)ccc1OC)(C#N)C#N

STK539684
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(1E)- 1- (4- methylphenyl)ethylidene]acetohydrazide
Smiles: O=C(Cn1nnnc1N)N/N=C(/c1ccc(cc1)C)\C

STK539686
Synonyms: 2,3- dimethoxy- 6- [(E)- {2- [(6- oxo- 1,6- dihydropyridazin- 3- yl)carbonyl]hydrazinylidene}methyl]benzoicacid
Smiles: COc1c(OC)ccc(c1C(=O)O)/C=N/NC(=O)c1ccc(=O)[nH]n1

STK539687
Synonyms: 2- (4- {[4- (3- methylphenyl)- 5- oxo- 4,5,6,7,8,9- hexahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}butyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: Cc1cccc(c1)n1c2nnc(n2c2c(c1=O)c1CCCCc1s2)SCCCCN1C(=O)c2c(C1=O)cccc2

STK539688
Synonyms: 3- benzyl- 2- {[1- (morpholin- 4- yl)- 1- oxopropan- 2- yl]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)Cc1ccccc1)SC(C(=O)N1CCOCC1)C)C

STK539689
Synonyms: 2- cyclopropyl- N'- [(E)- (3- methoxyphenyl)methylidene]quinoline- 4- carbohydrazide
Smiles: COc1cccc(c1)/C=N/NC(=O)c1cc(nc2c1cccc2)C1CC1

STK539690
Synonyms: N- {1- butyl- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}- 4- fluorobenzenesulfonamide
Smiles: CCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)F)S(=O)(=O)c1ccc(cc1)C

STK539691
Synonyms: 3- methyl- 7- (4- methylbenzyl)- 8- {[2- (piperidin- 1- yl)ethyl]sulfanyl}- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1ccc(cc1)Cn1c(SCCN2CCCCC2)nc2c1c(=O)[nH]c(=O)n2C

STK539693
Synonyms: 8- [(2E)- 2- (4- hydroxybenzylidene)hydrazinyl]- 1,3- dimethyl- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(N/N=C/c2ccc(cc2)O)nc2c1c(=O)n(c(=O)n2C)C

STK539694
Synonyms: (5E)- 2- [4- (3- chlorophenyl)piperazin- 1- yl]- 5- (2- propoxybenzylidene)- 1,3- thiazol- 4(5H)- one
Smiles: CCCOc1ccccc1/C=C\1/SC(=NC1=O)N1CCN(CC1)c1cccc(c1)Cl

STK539695
Synonyms: N'- [(E)- (3- methoxy- 4- propoxyphenyl)methylidene]- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: CCCOc1ccc(cc1OC)/C=N/NC(=O)CSc1nnc(n1C)c1ccccc1

STK539696
Synonyms: 7- (2- chlorobenzyl)- 1,3- dimethyl- 8- (prop- 2- en- 1- ylamino)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCNc1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C

STK539698
Synonyms: (8S)- 6- amino- 8- (3- methoxy- 4- propoxyphenyl)- 2- (propan- 2- yl)- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: CCCOc1ccc(cc1OC)[C@@H]1C2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(C)C

STK539699
Synonyms: 2- [(3- benzyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N- phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3

STK539700
Synonyms: 2- [(2E)- 2- (2- fluorobenzylidene)hydrazinyl]- 4,6- dimethylpyrimidine
Smiles: Cc1cc(C)nc(n1)N/N=C/c1ccccc1F

STK539701
Synonyms: N'- [(E)- (2- fluorophenyl)methylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/c1ccccc1F

STK539702
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (3- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cccc(c1)/C=N/NC(=O)CSc1nnc(n1C)c1cccc(c1)Br

STK539703
Synonyms: 4- (pyridin- 4- yl)- 2,3- diaza- 5- azoniaspiro[4.5]deca- 1,3- diene- 1- thiolate
Smiles: [S-]C1=NN=C([N+]21CCCCC2)c1ccncc1

STK539705
Synonyms: 8- [(2E)- 2- (4- ethoxybenzylidene)hydrazinyl]- 7- (4- fluorobenzyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCOc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1ccc(cc1)F)c(=O)n(c(=O)n2C)C

STK539706
Synonyms: 4,6- dimethyl- 2- {(2E)- 2- [(2E)- 3- phenylprop- 2- en- 1- ylidene]hydrazinyl}pyrimidine
Smiles: Cc1cc(C)nc(n1)N/N=C/C=C/c1ccccc1

STK539707
Synonyms: N'- [(E)- {2- [(4- bromobenzyl)oxy]phenyl}methylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/c1ccccc1OCc1ccc(cc1)Br

STK539708
Synonyms: 8- (butylamino)- 7- (2- chlorobenzyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCNc1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C

STK539709
Synonyms: 2,2- difluoro- 2- (2,3,3,4,4,5,5- heptafluorotetrahydrofuran- 2- yl)- N- (6- methylpyridin- 2- yl)acetamide
Smiles: Cc1cccc(n1)NC(=O)C(C1(F)OC(C(C1(F)F)(F)F)(F)F)(F)F

STK539710
Synonyms: methyl2- {11- [2- (3,4- dimethoxyphenyl)ethyl]- 2- methyl- 4- oxo- 4,11- dihydro- 3H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 3- yl}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COc1cc(ccc1OC)CCn1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)c1sc2c(c1C(=O)OC)CCCC2

STK539711
Synonyms: 1- benzyl- 3- (4- fluorophenyl)- 7,9- dimethyl- 1,4- dihydro[1,2,4]triazino[3,4- f]purine- 6,8(7H,9H)- dione
Smiles: Fc1ccc(cc1)C1=NN(Cc2ccccc2)c2n(C1)c1c(=O)n(C)c(=O)n(c1n2)C

STK539712
Synonyms: 2- {3- [(2,4- dichlorophenoxy)methyl]- 4- methoxyphenyl}- 2,3- dihydro- 4H- chromen- 4- one
Smiles: COc1ccc(cc1COc1ccc(cc1Cl)Cl)C1CC(=O)c2c(O1)cccc2

STK539713
Synonyms: 6- chloro- 3- [(4- ethylpiperazin- 1- yl)methyl]- 2- methylquinolin- 4- ol
Smiles: CCN1CCN(CC1)Cc1c(C)nc2c(c1O)cc(cc2)Cl

STK539714
Synonyms: 2- {[3- cyano- 6- (3,4- dimethoxyphenyl)pyridin- 2- yl]sulfanyl}- N- (2,4- dimethoxyphenyl)acetamide
Smiles: COc1ccc(c(c1)OC)NC(=O)CSc1nc(ccc1C#N)c1ccc(c(c1)OC)OC

STK539715
Synonyms: 3- (4- methoxyphenyl)- 6- (propan- 2- yl)- 2- (prop- 2- en- 1- ylsulfanyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: C=CCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CC(OC3)C(C)C

STK539716
Synonyms: 2- {[4- (4- methylphenyl)- 5- oxo- 7- (propan- 2- yl)- 4,5,6,9- tetrahydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}acetamide
Smiles: NC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CC(OC3)C(C)C

STK539717
Synonyms: methyl2- {[3- (4- methoxyphenyl)- 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}propanoate
Smiles: COC(=O)C(Sc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CC(OC3)C(C)C)C

STK539718
Synonyms: 1- (8- methyl- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)- 2- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}ethanone
Smiles: Cc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F

STK539719
Synonyms: ethyl[(4- fluorophenyl)(hydroxy)methyl](phenylethynyl)phosphinate
Smiles: CCOP(=O)(C(c1ccc(cc1)F)O)C#Cc1ccccc1

STK539721
Synonyms: 3- amino- N- [2- (2- chlorophenyl)ethyl]- 6- (thiophen- 2- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)ccc(n2)c1cccs1)NCCc1ccccc1Cl

STK539722
Synonyms: (6aS,6bR,9aS,10R)- 8- (2,4- dimethylphenyl)- 10- [(4- methoxyphenyl)carbonyl]- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1C)C)C=Cc1c2cccc1

STK539724
Synonyms: 7- [3- (4- chlorophenoxy)- 2- hydroxypropyl]- 1,3- dimethyl- 8- (piperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Clc1ccc(cc1)OCC(Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCNCC1)O

STK539725
Synonyms: methyl5- bromo- 3- {[(4- fluorophenyl)sulfonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NS(=O)(=O)c1ccc(cc1)F)cc(cc2)Br

STK539726
Synonyms: (6aR,6bS,9aR,10S)- 10- [(3,4- dimethoxyphenyl)carbonyl]- 8- [3- (trifluoromethyl)phenyl]- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1OC)C(=O)[C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1cccc(c1)C(F)(F)F)C=Cc1c2cccc1

STK539727
Synonyms: (3aR,6aS)- 3- (4- nitrophenyl)- 5- phenyl- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: O=C1[C@H]2[C@@H](C(=O)N1c1ccccc1)ON=C2c1ccc(cc1)[N+](=O)[O-]

STK539728
Synonyms: 2- {[(2E)- 3- chlorobut- 2- en- 1- yl]sulfanyl}- 3- (cyclohexylmethyl)quinazolin- 4(3H)- one
Smiles: C/C(=C\CSc1nc2ccccc2c(=O)n1CC1CCCCC1)/Cl

STK539729
Synonyms: 2- (2,6- dimethylmorpholin- 4- yl)- 1- (2- methyl- 1H- indol- 3- yl)ethanone
Smiles: CC1CN(CC(O1)C)CC(=O)c1c(C)[nH]c2c1cccc2

STK539730
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- (pyrrolidin- 1- yl)ethanone
Smiles: Cc1ccc2c(c1)[nH]c(c2C(=O)CN1CCCC1)C

STK539731
Synonyms: (6aR,6bS,9aR,10S)- 8- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 10- (phenylcarbonyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: O=C1N(c2ccc3c(c2)OCCO3)C(=O)[C@@H]2[C@H]1[C@H]1C=Cc3c(N1[C@@H]2C(=O)c1ccccc1)cccc3

STK539732
Synonyms: 4- benzyl- 1- [(3- methylbutyl)sulfanyl]- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CC(CCSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CC(OC3)C(C)C)C

STK539733
Synonyms: N- (2- methoxyphenyl)- 2- {[5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl]sulfanyl}acetamide
Smiles: COc1ccccc1NC(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK539734
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (3,5- dibromo- 4- hydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1cc(Br)c(c(c1)Br)O

STK539736
Synonyms: methyl3- {[(3,5- dimethylpiperidin- 1- yl)acetyl]amino}- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CC(C)CC(C1)C)cc(c(c2)OC)OC

STK539737
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(1E)- 1- phenylethylidene]acetohydrazide
Smiles: O=C(Cn1nnnc1N)N/N=C(/c1ccccc1)\C

STK539738
Synonyms: (8S,8aR)- 6- amino- 2- benzyl- 8- (4- methoxynaphthalen- 1- yl)- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)Cc1ccccc1)c1ccc(c2c1cccc2)OC)(C#N)C#N

STK539740
Synonyms: N'- [(E)- (3- bromophenyl)methylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1cncn1)N/N=C/c1cccc(c1)Br

STK539741
Synonyms: methyl5- methyl- 3- [(phenoxycarbonyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)Oc1ccccc1)cc(cc2)C

STK539743
Synonyms: 1- (4- fluorophenyl)- 2- (2- imino- 3- methyl- 2,3- dihydro- 1H- benzimidazol- 1- yl)ethanone
Smiles: Fc1ccc(cc1)C(=O)Cn1c(=N)n(c2c1cccc2)C

STK539744
Synonyms: 11- (3- bromophenyl)- N- (3,4- dichlorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Brc1cccc(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(c(c1)Cl)Cl)c1ccccc1

STK539745
Synonyms: methyl[(2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- yl)sulfanyl]acetate
Smiles: COC(=O)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C

STK539746
Synonyms: methyl5- chloro- 3- {[(3- methoxyphenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COc1cccc(c1)C(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC

STK539747
Synonyms: 7- (4- decanoylpiperazin- 1- yl)- 1- ethyl- 6- fluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCCCCCCCCC(=O)N1CCN(CC1)c1cc2n(CC)cc(c(=O)c2cc1F)C(=O)O

STK539748
Synonyms: 8- [(3,4- dichlorobenzyl)sulfanyl]- 2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: Clc1ccc(cc1Cl)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C

STK539750
Synonyms: methyl2- ({[2- amino- 1- (4- chlorobenzyl)- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl]carbonyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc(cc1)Cl

STK539751
Synonyms: 1,3- dimethyl- 8- [(2E)- 2- (4- nitrobenzylidene)hydrazinyl]- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc2c1c(=O)n(c(=O)n2C)C

STK539752
Synonyms: 7- benzyl- 8- [(2E)- 2- (2,4- dihydroxybenzylidene)hydrazinyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Oc1ccc(c(c1)O)/C=N/Nc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

STK539753
Synonyms: 1- (hexylsulfanyl)- 4- (3- methylphenyl)- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CCC3

STK539754
Synonyms: 6- hydroxy- 4- oxo- N'- [(E)- pyridin- 4- ylmethylidene]- 1,2- dihydro- 4H- pyrrolo[3,2,1- ij]quinoline- 5- carbohydrazide
Smiles: O=C(c1c(O)c2cccc3c2n(c1=O)CC3)N/N=C/c1ccncc1

STK539755
Synonyms: 3- methyl- 8- (morpholin- 4- yl)- 7- [2- (piperidin- 1- yl)ethyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=c1[nH]c(=O)c2c(n1C)nc(n2CCN1CCCCC1)N1CCOCC1

STK539756
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(E)- {2- [(3- bromobenzyl)oxy]phenyl}methylidene]acetohydrazide
Smiles: O=C(Cn1nnnc1N)N/N=C/c1ccccc1OCc1cccc(c1)Br

STK539757
Synonyms: 2- (azepan- 1- yl)- N- [4- (1,3- benzothiazol- 2- ylsulfanyl)- 3- chlorophenyl]- 5- nitrobenzamide
Smiles: Clc1cc(ccc1Sc1nc2c(s1)cccc2)NC(=O)c1cc(ccc1N1CCCCCC1)[N+](=O)[O-]

STK539758
Synonyms: (6aR,6bS,9aR,10S)- 10- acetyl- 8- (3- chlorophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Clc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)C

STK539759
Synonyms: (9E)- 9- (2- chlorobenzylidene)- 5- (2- chlorophenyl)- 3- (4- fluorophenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: Fc1ccc(cc1)c1csc2=NC3=C(C(n12)c1ccccc1Cl)CCC/C/3=C\c1ccccc1Cl

STK539760
Synonyms: N'- [(E)- (2,4- dimethoxyphenyl)methylidene]- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: COc1cc(OC)ccc1/C=N/NC(=O)CSc1nnc(n1C)c1ccccc1

STK539762
Synonyms: 5- (4- tert- butylphenyl)- 7,9- dichloro- 2- (3,4- dimethoxyphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: COc1ccc(cc1OC)C1=NN2C(C1)c1cc(Cl)cc(c1OC2c1ccc(cc1)C(C)(C)C)Cl

STK539763
Synonyms: methyl3- {[(2,6- dimethylmorpholin- 4- yl)acetyl]amino}- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CC(C)OC(C1)C)cc(cc2)C

STK539764
Synonyms: (8S,8aR,11aS,11bS)- 8- acetyl- 10- (2,4- dimethylphenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: CC(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1C=Cc1c2cccc1)c1ccc(cc1C)C

STK539765
Synonyms: 8,8- dimethyl- 4- (octadecyloxy)- 7,10- dihydro- 8H- pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CCCCCCCCCCCCCCCCCCOc1ncnc2c1sc1c2cc2c(n1)CC(OC2)(C)C

STK539766
Synonyms: benzyl(8R,8aR)- 6- amino- 5,7,7- tricyano- 8- (2,4- dichlorophenyl)- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)C(=O)OCc1ccccc1)c1ccc(cc1Cl)Cl)(C#N)C#N

STK539767
Synonyms: 8- [(2E)- 2- (4- ethoxybenzylidene)hydrazinyl]- 7- ethyl- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCOc1ccc(cc1)/C=N/Nc1nc2c(n1CC)c(=O)n(c(=O)n2C)C

STK539769
Synonyms: (6aS,6bR,9aS,10R)- 10- [(4- bromophenyl)carbonyl]- 8- (4- butoxyphenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: CCCCOc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)c1ccc(cc1)Br

STK539770
Synonyms: 5- (4- tert- butylphenyl)- 9- chloro- 2- (4- ethoxyphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: CCOc1ccc(cc1)C1=NN2C(C1)c1cc(Cl)ccc1OC2c1ccc(cc1)C(C)(C)C

STK539771
Synonyms: 1- (4- chlorophenyl)- 2- [(8,8- dimethyl- 7,10- dihydro- 8H- pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 4- yl)oxy]ethanone
Smiles: Clc1ccc(cc1)C(=O)COc1ncnc2c1sc1c2cc2c(n1)CC(OC2)(C)C

STK539772
Synonyms: 2- ethyl- 3,11- bis(2- phenylethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCc1nc2c(c(=O)n1CCc1ccccc1)c1c(n2CCc2ccccc2)nc2c(n1)cccc2

STK539774
Synonyms: N'- [(1E)- 1- (4- methoxyphenyl)ethylidene]- 2- methylquinoline- 4- carbohydrazide
Smiles: COc1ccc(cc1)/C(=N/NC(=O)c1cc(C)nc2c1cccc2)/C

STK539775
Synonyms: 4,6- dimethyl- 2- (thiomorpholin- 4- yl)pyridine- 3- carbonitrile
Smiles: N#Cc1c(C)cc(nc1N1CCSCC1)C

STK539777
Synonyms: methyl3- ({2- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]propanoyl}amino)- 5- chloro- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(CC1)Cc1ccc3c(c1)OCO3)C)cc(cc2)Cl

STK539778
Synonyms: 3- {[(E)- (2,4- dichlorophenyl)methylidene]amino}- 8- methoxy- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc(cc1Cl)Cl

STK539779
Synonyms: 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N'- {(E)- [4- (propan- 2- yl)phenyl]methylidene}acetohydrazide
Smiles: CC(c1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1C)c1ccccc1)C

STK539780
Synonyms: methyl5- chloro- 3- {[(3- methylphenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1cccc(c1)C)cc(cc2)Cl

STK539781
Synonyms: 2- (8- methyl- 1,2,3a,4,5,6- hexahydro- 3H- pyrazino[3,2,1- jk]carbazol- 3- yl)- N'- [(E)- phenylmethylidene]acetohydrazide
Smiles: O=C(CN1CCn2c3C1CCCc3c1c2ccc(c1)C)N/N=C/c1ccccc1

STK539782
Synonyms: (1'R,3R,3'R)- 1'- [(4- bromophenyl)carbonyl]- 3'- [(4- fluorophenyl)carbonyl]- 3',3a'- dihydrospiro[indole- 3,2'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: Fc1ccc(cc1)C(=O)[C@H]1C2C=Cc3c(N2[C@H]([C@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)Br)cccc3

STK539783
Synonyms: 3- methyl- 7- octyl- 8- [(3- oxobutan- 2- yl)sulfanyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCCn1c(SC(C(=O)C)C)nc2c1c(=O)[nH]c(=O)n2C

STK539784
Synonyms: 6- (2- {[(E)- (5- chloro- 2- hydroxyphenyl)methylidene]amino}phenoxy)- 1,3- dimethylpyrimidine- 2,4(1H,3H)- dione
Smiles: Clc1ccc(c(c1)/C=N/c1ccccc1Oc1cc(=O)n(c(=O)n1C)C)O

STK539785
Synonyms: methyl2- [11- (3,4- dimethylphenyl)- 2- ethyl- 4- oxo- 4,11- dihydro- 3H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 3- yl]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c2CCCCc2sc1n1c(CC)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)C)C

STK539787
Synonyms: 3- (benzylsulfanyl)- 5- methyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: Cc1nc2sc3c(c2c2n1c(SCc1ccccc1)nn2)CCC3

STK539788
Synonyms: 8- ethyl- 9- (heptylsulfanyl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1CC)CCc1c3cccc1

STK539789
Synonyms: 3,6- diamino- N- [2- (3- chlorophenyl)ethyl]- 5- cyanothieno[2,3- b]pyridine- 2- carboxamide
Smiles: N#Cc1cc2c(nc1N)sc(c2N)C(=O)NCCc1cccc(c1)Cl

STK539791
Synonyms: 2- {[5- (3- bromophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- {(E)- [4- (diethylamino)phenyl]methylidene}acetohydrazide
Smiles: CCN(c1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1c1ccccc1)c1cccc(c1)Br)CC

STK539793
Synonyms: 4- {[bis(2- methylpropyl)amino]methyl}- 3- hydroxy- 6H- benzo[c]chromen- 6- one
Smiles: CC(CN(Cc1c(O)ccc2c1oc(=O)c1c2cccc1)CC(C)C)C

STK539794
Synonyms: 2- {[4- chloro- 5- methyl- 2- (propan- 2- yl)phenoxy]methyl}- 8,9- bis(4- methoxyphenyl)furo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccc(cc1)c1c(oc2c1c1nc(nn1cn2)COc1cc(C)c(cc1C(C)C)Cl)c1ccc(cc1)OC

STK539795
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- {(E)- [4- (dimethylamino)phenyl]methylidene}acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1ccc(cc1)N(C)C

STK539796
Synonyms: methyl(2- bromo- 1- hydroxy- 1- phenylethyl)prop- 1- yn- 1- ylphosphinate
Smiles: BrCC(P(=O)(C#CC)OC)(c1ccccc1)O

STK539797
Synonyms: N'- [(E)- (5- chloro- 3- methyl- 1- phenyl- 1H- pyrazol- 4- yl)methylidene]- 2- cyclopropylquinoline- 4- carbohydrazide
Smiles: Cc1nn(c(c1/C=N/NC(=O)c1cc(nc2c1cccc2)C1CC1)Cl)c1ccccc1

STK539799
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (3,4,5- trimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2C)c2cccc(c2)Br)cc(c1OC)OC

STK539800
Synonyms: N- (4- methylphenyl)- 2- [(4- oxo- 3- phenyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCCC3

STK539801
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(E)- (1- ethyl- 3,5- dimethyl- 1H- pyrazol- 4- yl)methylidene]acetohydrazide
Smiles: CCn1nc(c(c1C)/C=N/NC(=O)Cn1nnnc1N)C

STK539803
Synonyms: 2- [(2- oxopropyl)sulfanyl]- 6- phenyl- 4- (thiophen- 2- yl)pyridine- 3- carbonitrile
Smiles: N#Cc1c(SCC(=O)C)nc(cc1c1cccs1)c1ccccc1

STK539804
Synonyms: 1- (heptylsulfanyl)- 4- (3- methylphenyl)- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CCCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CCC3

STK539805
Synonyms: 3- (2- methoxyphenyl)- 2- [(4- methylbenzyl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: COc1ccccc1n1c(SCc2ccc(cc2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK539807
Synonyms: ethyl(8S,8aR)- 6- amino- 5,7,7- tricyano- 8- [4- (methylsulfanyl)phenyl]- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1ccc(cc1)SC)C(C(=C2C#N)N)(C#N)C#N

STK539808
Synonyms: (5E)- 5- (4- ethoxybenzylidene)- 2- [4- (2- nitrophenyl)piperazin- 1- yl]- 1,3- thiazol- 4(5H)- one
Smiles: CCOc1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccccc1[N+](=O)[O-]

STK539809
Synonyms: ethyl(1- hydroxy- 1- phenylethyl)(phenylethynyl)phosphinate
Smiles: CCOP(=O)(C(c1ccccc1)(O)C)C#Cc1ccccc1

STK539810
Synonyms: 2- (2- {4- [2- (4- chlorophenyl)- 2- oxoethyl]piperazin- 1- yl}ethyl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)C(=O)CN1CCN(CC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK539811
Synonyms: methyl5- chloro- 3- ({2- [(3S)- 4- (3- methoxyphenyl)- 3- methylpiperazin- 1- yl]propanoyl}amino)- 1H- indole- 2- carboxylate
Smiles: COc1cccc(c1)N1CCN(CC1C)C(C(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC)C

STK539812
Synonyms: ethyl4- {[(4- tert- butylphenyl)carbonyl]amino}- 3- ethyl- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carboxylate
Smiles: CCOC(=O)c1sc(=S)n(c1NC(=O)c1ccc(cc1)C(C)(C)C)CC

STK539813
Synonyms: (2E)- N- (2,4- dichlorophenyl)- 2- (4- fluorobenzylidene)hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1Cl)Cl)N/N=C/c1ccc(cc1)F

STK539815
Synonyms: (8R,8aR,11aS,11bS)- 8- acetyl- 10- (2- fluorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: CC(=O)[C@@H]1N2C=Cc3c([C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1F)cccc3

STK539816
Synonyms: 7- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- N- (3- methyl- 1- phenylbutyl)heptanamide
Smiles: CC(CC(c1ccccc1)NC(=O)CCCCCCN1C(=O)c2c(C1=O)cccc2)C

STK539817
Synonyms: (2E)- N- (2,4- dichlorophenyl)- 2- (1H- indol- 3- ylmethylidene)hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1Cl)Cl)N/N=C/c1c[nH]c2c1cccc2

STK539820
Synonyms: 1,3- dimethyl- 7- (2- phenylethyl)- 8- (prop- 2- en- 1- ylamino)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCNc1nc2c(n1CCc1ccccc1)c(=O)n(c(=O)n2C)C

STK539821
Synonyms: 1- heptyl- 2- hydroxy- 4- imino- N'- [(E)- pyridin- 2- ylmethylidene]- 1,4- dihydroquinoline- 3- carbohydrazide
Smiles: CCCCCCCn1c(O)c(C(=O)N/N=C/c2ccccn2)c(=N)c2c1cccc2

STK539822
Synonyms: N'- [(E)- 1,3- benzodioxol- 5- ylmethylidene]- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1ccc2c(c1)OCO2

STK539823
Synonyms: 2- (4- {[(3,4- difluorophenyl)carbonyl]carbamothioyl}piperazin- 1- yl)- 8- ethyl- 5- oxo- 5,8- dihydropyrido[2,3- d]pyrimidine- 6- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1nc(nc2)N1CCN(CC1)C(=S)NC(=O)c1ccc(c(c1)F)F

STK539824
Synonyms: N'- cyclopentylidene- 2- {[5- (pyridin- 4- yl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}acetohydrazide
Smiles: O=C(NN=C1CCCC1)CSc1nnc(o1)c1ccncc1

STK539825
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- {4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}ethanone
Smiles: Cc1ccc2c(c1)[nH]c(c2C(=O)CN1CCN(CC1)C/C=C/c1ccccc1)C

STK539826
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(E)- (5- bromo- 2- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccc(cc1/C=N/NC(=O)Cn1nnnc1N)Br

STK539827
Synonyms: methyl3- {[(4- fluorophenyl)sulfonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NS(=O)(=O)c1ccc(cc1)F)cccc2

STK539828
Synonyms: 1,3- dimethyl- 7- (propan- 2- yl)- 8- (prop- 2- en- 1- ylamino)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCNc1nc2c(n1C(C)C)c(=O)n(c(=O)n2C)C

STK539830
Synonyms: 8- (cyclohexylmethyl)- 9- (hexylsulfanyl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CCCCCCSc1nc2sc3c(c2c(=O)n1CC1CCCCC1)CCc1c3cccc1

STK539832
Synonyms: (2E)- 2- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 3- (4- hydroxyphenyl)prop- 2- enenitrile
Smiles: N#C/C(=C\c1ccc(cc1)O)/c1scc(n1)c1ccc(cc1)Br

STK539836
Synonyms: 4- (4- benzylpiperazin- 1- yl)- 7- methyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine
Smiles: CC1CCc2c(C1)sc1c2c(ncn1)N1CCN(CC1)Cc1ccccc1

STK539837
Synonyms: 2,3,3,3- tetrafluoro- 2- [1,1,2,3,3,3- hexafluoro- 2- (heptafluoropropoxy)propoxy]- N- (4- nitrophenyl)propanamide
Smiles: O=C(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)Nc1ccc(cc1)[N+](=O)[O-]

STK539838
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (2- hydroxy- 3- methoxy- 5- nitrophenyl)methylidene]acetohydrazide
Smiles: COc1cc(cc(c1O)/C=N/NC(=O)CSc1nnc(n1C)c1cccc(c1)Br)[N+](=O)[O-]

STK539839
Synonyms: 2,2,3,3,4,4,5,5,5- nonafluoro- N- (6- methylpyridin- 2- yl)pentanamide
Smiles: O=C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)Nc1cccc(n1)C

STK539840
Synonyms: ethyl3- (decanoylamino)- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCCCCCCCCC(=O)Nc1c([nH]c2c1cc(OC)cc2)C(=O)OCC

STK539841
Synonyms: 7- (2- chlorobenzyl)- 1,3- dimethyl- 8- [(2E)- 2- (4- nitrobenzylidene)hydrazinyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Clc1ccccc1Cn1c(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc2c1c(=O)n(c(=O)n2C)C

STK539843
Synonyms: 3- ({(E)- [4- (dimethylamino)phenyl]methylidene}amino)- 2- propylquinazolin- 4(3H)- one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1ccc(cc1)N(C)C

STK539844
Synonyms: 2- [(2,4- dichlorobenzyl)sulfanyl]- 3- (2- methoxyphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: COc1ccccc1n1c(SCc2ccc(cc2Cl)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK539845
Synonyms: N- (9,10- dioxo- 9,10- dihydroanthracen- 1- yl)- 2,2,3,3,4,4,5,5,6,6,7,7,7- tridecafluoroheptanamide
Smiles: O=C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Nc1cccc2c1C(=O)c1ccccc1C2=O

STK539846
Synonyms: methyl2- ({[2- amino- 1- (4- ethylphenyl)- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl]carbonyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2

STK539847
Synonyms: 3- {[(E)- (4- bromophenyl)methylidene]amino}- 2- propylquinazolin- 4(3H)- one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1ccc(cc1)Br

STK539849
Synonyms: (5Z)- 5- {[5- (4- methylphenyl)furan- 2- yl]methylidene}- 2- (4- phenylpiperazin- 1- yl)- 1,3- thiazol- 4(5H)- one
Smiles: Cc1ccc(cc1)c1ccc(o1)/C=C/1\SC(=NC1=O)N1CCN(CC1)c1ccccc1

STK539850
Synonyms: 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N'- [(E)- (5- nitrothiophen- 2- yl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1ccc(s1)[N+](=O)[O-]

STK539852
Synonyms: N'- {(E)- [2- (benzyloxy)phenyl]methylidene}- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1ccccc1OCc1ccccc1

STK539853
Synonyms: 4- (3- methylphenyl)- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Cc1cccc(c1)n1c(=O)c2c3CCCc3sc2n2c1nnc2

STK539857
Synonyms: 8- [(2Z)- 2- (5- bromo- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)hydrazinyl]- 7- (4- fluorobenzyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccc(cc1)Cn1c(N/N=C/2\C(=O)Nc3c2cc(Br)cc3)nc2c1c(=O)n(c(=O)n2C)C

STK539858
Synonyms: 3- (3- methylphenyl)- 2- pentylquinazolin- 4(3H)- one
Smiles: CCCCCc1nc2ccccc2c(=O)n1c1cccc(c1)C

STK539859
Synonyms: 2- [(4- methylbenzyl)sulfanyl]- 3- (2- methylphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Cc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3

STK539861
Synonyms: N- (4- chlorophenyl)- 2- {[5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK539862
Synonyms: (2E)- N- (2,4- dichlorophenyl)- 2- (furan- 2- ylmethylidene)hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1Cl)Cl)N/N=C/c1ccco1

STK539863
Synonyms: 3- cyclohexyl- 11- [2- (3,4- dimethoxyphenyl)ethyl]- 2- methyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccc(cc1OC)CCn1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)C1CCCCC1

STK539864
Synonyms: 8- [(3- hydroxypropyl)amino]- 1,3- dimethyl- 7- (propan- 2- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCCCNc1nc2c(n1C(C)C)c(=O)n(c(=O)n2C)C

STK539865
Synonyms: methyl2- [({2- amino- 1- [2- (4- methoxyphenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl}carbonyl)amino]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COc1ccc(cc1)CCn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2

STK539866
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}ethanone
Smiles: Cc1ccc2c(c1)[nH]c(c2C(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F)C

STK539867
Synonyms: ethyl3- bromo- 4- hydroxy- 2- methyl- 5- oxo- 1- phenyl- 2,5- dihydro- 1H- pyrrole- 2- carboxylate
Smiles: CCOC(=O)C1(C)N(c2ccccc2)C(=O)C(=C1Br)O

STK539868
Synonyms: 2- (3- chlorophenyl)- 2,3- dihydro- 1H- naphtho[1,2- e][1,3]oxazine
Smiles: Clc1cccc(c1)N1COc2c(C1)c1ccccc1cc2

STK539870
Synonyms: 2- cyclopropyl- N'- [(E)- (4- nitrophenyl)methylidene]quinoline- 4- carbohydrazide
Smiles: O=C(c1cc(nc2c1cccc2)C1CC1)N/N=C/c1ccc(cc1)[N+](=O)[O-]

STK539871
Synonyms: N- (4- {[3- (4- ethylpiperazin- 1- yl)- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl]sulfamoyl}phenyl)acetamide
Smiles: CCN1CCN(CC1)C1=C(NS(=O)(=O)c2ccc(cc2)NC(=O)C)C(=O)c2c(C1=O)cccc2

STK539872
Synonyms: N'- [(E)- (2- chlorophenyl)methylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1cncn1)N/N=C/c1ccccc1Cl

STK539873
Synonyms: 6- ethoxy- 3,3- dimethyl- 8- (2- methylpropyl)- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: CCOc1nc(CC(C)C)c2c(c1C#N)CC(OC2)(C)C

STK539874
Synonyms: N'- [(E)- 1,3- benzodioxol- 5- ylmethylidene]- 2- methylimidazo[1,2- a]pyridine- 3- carbohydrazide
Smiles: O=C(c1c(C)nc2n1cccc2)N/N=C/c1ccc2c(c1)OCO2

STK539878
Synonyms: 2- (1,3- benzothiazol- 2- ylsulfanyl)- N'- {(E)- [5- (4- fluorophenyl)- 1H- pyrazol- 4- yl]methylidene}acetohydrazide
Smiles: O=C(CSc1nc2c(s1)cccc2)N/N=C/c1cn[nH]c1c1ccc(cc1)F

STK539879
Synonyms: (1S,2R,3aR)- 7- chloro- 2- (thiophen- 3- yl)- 1- (tricyclo[3.3.1.1~3,7~]dec- 1- ylcarbonyl)- 1,2- dihydropyrrolo[1,2- a]quinoline- 3,3(3aH)- dicarbonitrile
Smiles: N#CC1(C#N)[C@H](c2cscc2)[C@H](N2[C@@H]1C=Cc1c2ccc(c1)Cl)C(=O)C12CC3CC(C2)CC(C1)C3

STK539880
Synonyms: 2- {3- [2- (3,4- dimethoxyphenyl)ethyl]- 1- (4- methylphenyl)- 5- oxo- 2- thioxoimidazolidin- 4- yl}- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CC1N(CCc2ccc(c(c2)OC)OC)C(=S)N(C1=O)c1ccc(cc1)C

STK539881
Synonyms: N'- [(E)- (4- chlorophenyl)methylidene]- 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1ccc(cc1)Cl

STK539882
Synonyms: N'- {(E)- [2- hydroxy- 3- (prop- 2- en- 1- yl)phenyl]methylidene}- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: C=CCc1cccc(c1O)/C=N/NC(=O)CSc1nnc(n1C)c1ccccc1

STK539883
Synonyms: 3- {[(E)- (2- hydroxynaphthalen- 1- yl)methylidene]amino}- 2- propylquinazolin- 4(3H)- one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1c(O)ccc2c1cccc2

STK539884
Synonyms: N- (2- methoxyphenyl)- 2- {[4- (4- methoxyphenyl)- 5- oxo- 7- (propan- 2- yl)- 4,5,6,9- tetrahydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CC(OCc1s2)C(C)C)SCC(=O)Nc1ccccc1OC

STK539885
Synonyms: 3- (3- methylphenyl)- 2- {[2- oxo- 2- (piperidin- 1- yl)ethyl]sulfanyl}quinazolin- 4(3H)- one
Smiles: Cc1cccc(c1)n1c(SCC(=O)N2CCCCC2)nc2c(c1=O)cccc2

STK539886
Synonyms: (1E)- N- {[8,9- bis(4- methoxyphenyl)furo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}- 1- (4- bromophenyl)ethanimine
Smiles: COc1ccc(cc1)c1c(oc2c1c1nc(nn1cn2)CO/N=C(/c1ccc(cc1)Br)\C)c1ccc(cc1)OC

STK539887
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- (4- phenylpiperazin- 1- yl)ethanone
Smiles: Cc1ccc2c(c1)[nH]c(c2C(=O)CN1CCN(CC1)c1ccccc1)C

STK539888
Synonyms: 8- {(2E)- 2- [4- (dimethylamino)benzylidene]hydrazinyl}- 3- methyl- 7- (4- nitrobenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CN(c1ccc(cc1)/C=N/Nc1nc2c(n1Cc1ccc(cc1)[N+](=O)[O-])c(=O)[nH]c(=O)n2C)C

STK539889
Synonyms: tert- butyl6- amino- 5,7,7- tricyano- 8- (3,4- difluorophenyl)- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: N#CC1=C(N)C(C(C2C1=CCN(C2)C(=O)OC(C)(C)C)c1ccc(c(c1)F)F)(C#N)C#N

STK539890
Synonyms: (6aR,6bS,9aR,10S)- 8- (4- bromophenyl)- 10- (phenylcarbonyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Brc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)c1ccccc1

STK539891
Synonyms: methyl6'- amino- 1- (2- chlorobenzyl)- 5'- cyano- 2'- (2- methoxy- 2- oxoethyl)- 2- oxo- 1,2- dihydrospiro[indole- 3,4'- pyran]- 3'- carboxylate
Smiles: COC(=O)C1=C(CC(=O)OC)OC(=C(C21c1ccccc1N(C2=O)Cc1ccccc1Cl)C#N)N

STK539893
Synonyms: methyl5,6- dimethoxy- 3- {[(3- methoxyphenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COc1cccc(c1)C(=O)Nc1c([nH]c2c1cc(OC)c(c2)OC)C(=O)OC

STK539894
Synonyms: (9E)- 9- [4- (difluoromethoxy)benzylidene]- 5- [4- (difluoromethoxy)phenyl]- 3- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: FC(Oc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc3c(c1)OCCO3)/C(=C/c1ccc(cc1)OC(F)F)/CCC2)F

STK539895
Synonyms: 8- bromo- 7- (3- chloro- 2- hydroxypropyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: ClCC(Cn1c(Br)nc2c1c(=O)n(C)c(=O)n2C)O

STK539896
Synonyms: N- {3- [(4- methylphenyl)sulfonyl]- 1- (1- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}naphthalene- 2- sulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(NS(=O)(=O)c2ccc3c(c2)cccc3)n(c2c1nc1ccccc1n2)C(c1ccccc1)C

STK539898
Synonyms: 3- methyl- 8,13- dioxo- 13,14- dihydro- 8H- naphtho[2,3- a]phenothiazin- 7- ylbenzoate
Smiles: Cc1ccc2c(c1)sc1c([nH]2)c2c(c(c1)OC(=O)c1ccccc1)c(=O)c1c(c2=O)cccc1

STK539899
Synonyms: 3- (4- methoxyphenyl)- 2- [(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: COc1ccc(cc1)n1c(SCCc2ccccc2)nc2c(c1=O)c1CC(OCc1s2)C(C)C

STK539900
Synonyms: (2E)- 2- [1- (5,5- dimethyl- 2- oxotetrahydrofuran- 3- yl)propan- 2- ylidene]hydrazinecarboxamide
Smiles: C/C(=N\NC(=O)N)/CC1CC(OC1=O)(C)C

STK539901
Synonyms: N'- [(E)- (3,4- dimethoxyphenyl)methylidene]- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2C)c2ccccc2)ccc1OC

STK539902
Synonyms: N- benzyl- 2- {[4- (4- methylphenyl)- 5- oxo- 7- (propan- 2- yl)- 4,5,6,9- tetrahydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}propanamide
Smiles: O=C(C(Sc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CC(OC3)C(C)C)C)NCc1ccccc1

STK539903
Synonyms: (8R,8aR)- 6- amino- 8- (2- fluoro- 5- methoxyphenyl)- 2- (propan- 2- yl)- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)C(C)C)c1cc(OC)ccc1F)(C#N)C#N

STK539904
Synonyms: 2- [(4- methylbenzyl)sulfanyl]- 3- (prop- 2- en- 1- yl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: C=CCn1c(SCc2ccc(cc2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK539906
Synonyms: 3,6- diamino- 5- cyano- N- (2,4- dimethylphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: N#Cc1cc2c(nc1N)sc(c2N)C(=O)Nc1ccc(cc1C)C

STK539907
Synonyms: ethyl5- cyano- 4- [4- (methoxycarbonyl)phenyl]- 6- [(2- methoxy- 2- oxoethyl)sulfanyl]- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)C(=O)OC)C#N)SCC(=O)OC

STK539909
Synonyms: 8- [(2E)- 2- (2- hydroxybenzylidene)hydrazinyl]- 7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(N/N=C/c2ccccc2O)nc2c1c(=O)n(C)c(=O)n2C)COc1ccccc1C

STK539910
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1Z)- 1- phenylbutylidene]acetohydrazide
Smiles: CCC/C(=N/NC(=O)CSc1nnc(n1C)c1ccc(cc1)Cl)/c1ccccc1

STK539911
Synonyms: ethyl(8S,8aR)- 6- amino- 5,7,7- tricyano- 8- (3,4,5- trimethoxyphenyl)- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1cc(OC)c(c(c1)OC)OC)C(C(=C2C#N)N)(C#N)C#N

STK539912
Synonyms: 6- oxo- N- (pyridin- 2- yl)- 1,6- dihydropyridazine- 3- carboxamide
Smiles: O=C(c1ccc(=O)[nH]n1)Nc1ccccn1

STK539914
Synonyms: 2- {[3- (3- methylphenyl)- 4- oxo- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- phenylpropanamide
Smiles: O=C(C(Sc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C)C)Nc1ccccc1

STK539915
Synonyms: methyl3- {[(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)cccc2

STK539917
Synonyms: 1- [(3,4- dichlorobenzyl)sulfanyl]- 4- (3- methylphenyl)- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Cc1cccc(c1)n1c(=O)c2c3CC(OCc3sc2n2c1nnc2SCc1ccc(c(c1)Cl)Cl)C(C)C

STK539918
Synonyms: 2- [(2E)- 2- {4- [(3,4- dichlorobenzyl)oxy]- 3- methoxybenzylidene}hydrazinyl]- 4,6- dimethylpyrimidine
Smiles: COc1cc(/C=N/Nc2nc(C)cc(n2)C)ccc1OCc1ccc(c(c1)Cl)Cl

STK539919
Synonyms: 3- benzyl- 2- (methylsulfanyl)- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(OC3)C(C)C

STK539921
Synonyms: 4- (3- methylphenyl)- 1- (propylsulfanyl)- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CCCSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CCC3

STK539922
Synonyms: (1'R,3R,3'R)- 1'- [(4- bromophenyl)carbonyl]- 3'- (pyridin- 4- ylcarbonyl)- 3',3a'- dihydrospiro[indole- 3,2'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccncc1

STK539923
Synonyms: (6aR,6bS,9aR,10S)- 10- [(3,4- dimethoxyphenyl)carbonyl]- 8- (4- methylphenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1OC)C(=O)[C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc(cc1)C)C=Cc1c2cccc1

STK539924
Synonyms: N- (4- methoxyphenyl)undec- 10- enamide
Smiles: C=CCCCCCCCCC(=O)Nc1ccc(cc1)OC

STK539925
Synonyms: 2- {4- [(4- chlorobenzyl)oxy]phenyl}- 4,4,8- trimethyl- 4,5- dihydro[1,2]thiazolo[5,4- c]quinoline- 1(2H)- thione
Smiles: Clc1ccc(cc1)COc1ccc(cc1)n1sc2c(c1=S)c1cc(C)ccc1NC2(C)C

STK539926
Synonyms: 7- [(2Z)- 3- chlorobut- 2- en- 1- yl]- 3- methyl- 8- {[2- (morpholin- 4- yl)ethyl]sulfanyl}- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C/C(=C/Cn1c(SCCN2CCOCC2)nc2c1c(=O)[nH]c(=O)n2C)/Cl

STK539929
Synonyms: 3- {[(E)- (5- bromo- 2- hydroxyphenyl)methylidene]amino}- 2- [(2- methylphenoxy)methyl]quinazolin- 4(3H)- one
Smiles: Brc1ccc(c(c1)/C=N/n1c(COc2ccccc2C)nc2c(c1=O)cccc2)O

STK539930
Synonyms: 3- {[(E)- (5- bromo- 2- hydroxy- 3- nitrophenyl)methylidene]amino}- 2- propylquinazolin- 4(3H)- one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1cc(Br)cc(c1O)[N+](=O)[O-]

STK539931
Synonyms: (6aR,6bS,9aR,10S)- 10- [(4- bromophenyl)carbonyl]- 2- chloro- 8- (2- fluorophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Clc1ccc2c(c1)N1[C@H](C=C2)[C@@H]2[C@H]([C@H]1C(=O)c1ccc(cc1)Br)C(=O)N(C2=O)c1ccccc1F

STK539932
Synonyms: methyl2- ({[2- amino- 1- (4- methylphenyl)- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl]carbonyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)C

STK539933
Synonyms: 1- (4- chlorophenyl)- 2- {[9- methyl- 5- (methylsulfanyl)- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}ethanone
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)c1ccc(cc1)Cl)nn2)CCN(C3)C

STK539934
Synonyms: 2- {[3- cyano- 6- (3,4- dimethoxyphenyl)pyridin- 2- yl]sulfanyl}- N- phenylacetamide
Smiles: N#Cc1ccc(nc1SCC(=O)Nc1ccccc1)c1ccc(c(c1)OC)OC

STK539935
Synonyms: (1'R,3R,3'R)- 1'- [(4- bromophenyl)carbonyl]- 3'- [(2,5- dimethoxyphenyl)carbonyl]- 3',3a'- dihydrospiro[indole- 3,2'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: COc1ccc(c(c1)C(=O)[C@H]1C2C=Cc3c(N2[C@H]([C@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)Br)cccc3)OC

STK539936
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (4- hydroxy- 3- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2C)c2cccc(c2)Br)ccc1O

STK539937
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- [4- (4- fluorophenyl)piperazin- 1- yl]ethanone
Smiles: Fc1ccc(cc1)N1CCN(CC1)CC(=O)c1c(C)[nH]c2c1ccc(c2)C

STK539941
Synonyms: 6- ethyl- 2- {[(pyridin- 3- ylcarbonyl)carbamothioyl]amino}- 4,5,6,7- tetrahydrothieno[2,3- c]pyridine- 3- carboxamide
Smiles: CCN1CCc2c(C1)sc(c2C(=O)N)NC(=S)NC(=O)c1cccnc1

STK539942
Synonyms: ethyl6'- methyl- 4'- {[(phenylcarbonyl)carbamothioyl]amino}- 1'H- spiro[cyclohexane- 1,2'- naphthalene]- 3'- carboxylate
Smiles: CCOC(=O)C1=C(NC(=S)NC(=O)c2ccccc2)c2cc(C)ccc2CC21CCCCC2

STK539943
Synonyms: N,N'- ethane- 1,2- diylbis(6- oxo- 1,6- dihydropyridazine- 3- carboxamide)
Smiles: O=C(c1ccc(=O)[nH]n1)NCCNC(=O)c1ccc(=O)[nH]n1

STK539944
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (4- chlorophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1ccc(cc1)Cl

STK539945
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (2- fluorophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1ccccc1F

STK539947
Synonyms: 8- [(2E)- 2- (2- chlorobenzylidene)hydrazinyl]- 1,3- dimethyl- 7- (4- methylbenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1ccc(cc1)Cn1c(N/N=C/c2ccccc2Cl)nc2c1c(=O)n(c(=O)n2C)C

STK539948
Synonyms: [2- (2,5- dimethoxyphenyl)thiophen- 3- yl]aceticacid
Smiles: COc1ccc(cc1c1sccc1CC(=O)O)OC

STK539949
Synonyms: 1- (morpholin- 4- yl)- 2- [(5- propyl- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl)sulfanyl]propan- 1- one
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncnc3SC(C(=O)N1CCOCC1)C

STK539950
Synonyms: (5E)- 2- [4- (4- methylphenyl)piperazin- 1- yl]- 5- [4- (prop- 2- en- 1- yloxy)benzylidene]- 1,3- thiazol- 4(5H)- one
Smiles: C=CCOc1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccc(cc1)C

STK539951
Synonyms: 4- (pyridin- 4- yl)- 8- oxa- 2,3- diaza- 5- azoniaspiro[4.5]deca- 1,3- diene- 1- thiolate
Smiles: [S-]C1=NN=C([N+]21CCOCC2)c1ccncc1

STK539952
Synonyms: 3- amino- 6- (3- methoxyphenyl)- N- (3- methylphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1cccc(c1)C

STK539954
Synonyms: (8S,8aR,11aS,11bS)- 8- [(4- bromophenyl)carbonyl]- 10- (4- butoxyphenyl)- 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](N1[C@@H]2c2ccccc2C=C1)C(=O)c1ccc(cc1)Br

STK539955
Synonyms: (Z)- N- (9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- ylmethoxy)- 1- (4- methoxyphenyl)methanimine
Smiles: COc1ccc(cc1)/C=N\OCc1nn2c(n1)c1c(nc2)sc2c1CCC2

STK539956
Synonyms: 2- [(2E)- 2- (3- methoxy- 4- propoxybenzylidene)hydrazinyl]- 4,6- dimethylpyrimidine
Smiles: CCCOc1ccc(cc1OC)/C=N/Nc1nc(C)cc(n1)C

STK539957
Synonyms: (9E)- 9- (4- chlorobenzylidene)- 5- (4- chlorophenyl)- 3- (4- fluorophenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: Clc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)F)/C(=C/c1ccc(cc1)Cl)/CCC2

STK539959
Synonyms: (2E)- N- (2,4- dichlorophenyl)- 2- (pyridin- 4- ylmethylidene)hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1Cl)Cl)N/N=C/c1ccncc1

STK539962
Synonyms: 8- chloro- 3- {[(E)- (2,4- dihydroxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Oc1ccc(c(c1)O)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Cl

STK539963
Synonyms: 2- methyl- N'- [(1Z)- 1- phenylbutylidene]quinoline- 4- carbohydrazide
Smiles: CCC/C(=N/NC(=O)c1cc(C)nc2c1cccc2)/c1ccccc1

STK539965
Synonyms: N'- [(E)- (4- hydroxy- 3- methoxyphenyl)methylidene]- 2- methylquinoline- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2cc(C)nc3c2cccc3)ccc1O

STK539966
Synonyms: 7- (4- {[(4- chlorophenyl)acetyl]carbamothioyl}piperazin- 1- yl)- 1- ethyl- 6- fluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=S)NC(=O)Cc1ccc(cc1)Cl)c(c2)F

STK539967
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (4- ethoxy- 3- hydroxyphenyl)methylidene]acetohydrazide
Smiles: CCOc1ccc(cc1O)/C=N/NC(=O)CSc1nnc(n1C)c1ccc(cc1)Cl

STK539968
Synonyms: N- {3- [(4- methylphenyl)sulfonyl]- 1- (2- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}naphthalene- 2- sulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(NS(=O)(=O)c2ccc3c(c2)cccc3)n(c2c1nc1ccccc1n2)CCc1ccccc1

STK539969
Synonyms: (5E)- 5- (2- butoxybenzylidene)- 2- [4- (4- chlorophenyl)piperazin- 1- yl]- 1,3- thiazol- 4(5H)- one
Smiles: CCCCOc1ccccc1/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccc(cc1)Cl

STK539970
Synonyms: 6- amino- 4- (3- methoxy- 4- propoxyphenyl)- 3- methyl- 1- (4- methylphenyl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: CCCOc1ccc(cc1OC)C1C(=C(N)Oc2c1c(C)nn2c1ccc(cc1)C)C#N

STK539971
Synonyms: 7- ethyl- 8- [(2E)- 2- (4- hydroxybenzylidene)hydrazinyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(N/N=C/c2ccc(cc2)O)nc2c1c(=O)n(c(=O)n2C)C

STK539972
Synonyms: 3- {[(E)- (4- ethoxyphenyl)methylidene]amino}- 2- propylquinazolin- 4(3H)- one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1ccc(cc1)OCC

STK539974
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(2E)- 1- phenylbutan- 2- ylidene]acetohydrazide
Smiles: CC/C(=N\NC(=O)Cn1nnnc1N)/Cc1ccccc1

STK539977
Synonyms: 8- [(2E)- 2- (4- bromobenzylidene)hydrazinyl]- 1,3- dimethyl- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(N/N=C/c2ccc(cc2)Br)nc2c1c(=O)n(c(=O)n2C)C

STK539978
Synonyms: ethyl4- {3- [(4- chlorophenyl)carbonyl]- 4- hydroxy- 5- oxo- 2- phenyl- 2,5- dihydro- 1H- pyrrol- 1- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(c2ccccc2)C(=C(C1=O)O)C(=O)c1ccc(cc1)Cl

STK539979
Synonyms: N'- [(1E,2E)- 3- phenylprop- 2- en- 1- ylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1cncn1)N/N=C/C=C/c1ccccc1

STK539980
Synonyms: 6- ethyl- 2- ({[(2E)- 3- (4- methoxyphenyl)prop- 2- enoyl]carbamothioyl}amino)- 4,5,6,7- tetrahydrothieno[2,3- c]pyridine- 3- carboxamide
Smiles: CCN1CCc2c(C1)sc(c2C(=O)N)NC(=S)NC(=O)/C=C/c1ccc(cc1)OC

STK539981
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(E)- pyridin- 4- ylmethylidene]acetohydrazide
Smiles: O=C(Cn1nnnc1N)N/N=C/c1ccncc1

STK539982
Synonyms: N,N- diethyl- 2- {[5- (2- methylpropyl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)CC(C)C)CC

STK539985
Synonyms: methyl2- ({[2- amino- 1- (3,4- dichlorophenyl)- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl]carbonyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)Cl

STK539986
Synonyms: 2- methyl- N'- [(1Z)- 1- (naphthalen- 2- yl)ethylidene]quinoline- 4- carbohydrazide
Smiles: Cc1nc2ccccc2c(c1)C(=O)N/N=C(\c1ccc2c(c1)cccc2)/C

STK539987
Synonyms: 1- (3- bromophenyl)- 2- (4- bromophenyl)- 1H- imidazo[4,5- b]quinoxaline
Smiles: Brc1ccc(cc1)c1nc2c(n1c1cccc(c1)Br)nc1c(n2)cccc1

STK539989
Synonyms: 3- ({(E)- [5- hydroxy- 3- methyl- 1- (4- methylphenyl)- 1H- pyrazol- 4- yl]methylidene}amino)- 2- (phenoxymethyl)quinazolin- 4(3H)- one
Smiles: Cc1ccc(cc1)n1nc(c(c1O)/C=N/n1c(COc2ccccc2)nc2c(c1=O)cccc2)C

STK539990
Synonyms: ethyl(8S)- 6- amino- 5,7,7- tricyano- 8- [4- (propan- 2- yloxy)phenyl]- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCOC(=O)N1CC=C2C(C1)[C@@H](c1ccc(cc1)OC(C)C)C(C(=C2C#N)N)(C#N)C#N

STK539991
Synonyms: 2- (2- cyclooctylidenehydrazinyl)- N- [2- (3,4- dimethoxyphenyl)ethyl]- 2- oxoacetamide
Smiles: COc1cc(CCNC(=O)C(=O)NN=C2CCCCCCC2)ccc1OC

STK539992
Synonyms: ethyl4- {[(2- cyclooctylidenehydrazinyl)(oxo)acetyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)C(=O)NN=C1CCCCCCC1

STK539994
Synonyms: 4,6- dimethyl- 2- [(2E)- 2- (naphthalen- 1- ylmethylidene)hydrazinyl]pyrimidine
Smiles: Cc1cc(C)nc(n1)N/N=C/c1cccc2c1cccc2

STK539995
Synonyms: 2- cyclopropyl- N'- [(2Z,3E)- 4- phenylbut- 3- en- 2- ylidene]quinoline- 4- carbohydrazide
Smiles: C/C(=N/NC(=O)c1cc(nc2c1cccc2)C1CC1)/C=C/c1ccccc1

STK539996
Synonyms: 1,3- dimethyl- 7- (4- methylbenzyl)- 8- [(2E)- 2- (2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)hydrazinyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1ccc(cc1)Cn1c(N/N=C\2/C(=O)Nc3c2cccc3)nc2c1c(=O)n(c(=O)n2C)C

STK539997
Synonyms: 5- {4- [(4- chlorobenzyl)oxy]phenyl}- 2- (3,4- dimethoxyphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: COc1cc(ccc1OC)C1=NN2C(C1)c1ccccc1OC2c1ccc(cc1)OCc1ccc(cc1)Cl

STK539998
Synonyms: 2,2,5- trimethyl- 8- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CC(=C)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C

STK539999
Synonyms: N'- [(1E)- 1- (4- bromophenyl)ethylidene]- 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C(/c1ccc(cc1)Br)\C

STK540000
Synonyms: N'- [(E)- {2- [(4- chlorobenzyl)oxy]phenyl}methylidene]- 2- methylquinoline- 4- carbohydrazide
Smiles: Clc1ccc(cc1)COc1ccccc1/C=N/NC(=O)c1cc(C)nc2c1cccc2

STK540002
Synonyms: N'- [(E)- (3- bromo- 4- hydroxy- 5- methoxyphenyl)methylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cn2ncnc2)cc(c1O)Br

STK540004
Synonyms: N'- [(E)- (3,5- dibromo- 4- hydroxyphenyl)methylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1ncnc1)N/N=C/c1cc(Br)c(c(c1)Br)O

STK540005
Synonyms: 3- amino- 6- (3- methoxyphenyl)- N- [2- (trifluoromethyl)phenyl]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1ccccc1C(F)(F)F

STK540007
Synonyms: ethyl4- [(4- carbamoylphenyl)amino]- 2- methyl- 5- oxo- 1- phenyl- 2,5- dihydro- 1H- pyrrole- 2- carboxylate
Smiles: CCOC(=O)C1(C)C=C(C(=O)N1c1ccccc1)Nc1ccc(cc1)C(=O)N

STK540008
Synonyms: 3,6- diamino- 5- cyano- N- (3,5- dimethoxybenzyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cc(CNC(=O)c2sc3c(c2N)cc(c(n3)N)C#N)cc(c1)OC

STK540009
Synonyms: 3- (3- methylphenyl)- 2- (pentylsulfanyl)- 3,5,6,7- tetrahydro- 4H- cyclopenta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CCCCCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCC3

STK540013
Synonyms: N- benzylundec- 10- enamide
Smiles: C=CCCCCCCCCC(=O)NCc1ccccc1

STK540014
Synonyms: 2- (4- chlorophenyl)- 4- {(2E)- 2- [1- (4- methylphenyl)ethylidene]hydrazinyl}quinazoline
Smiles: Cc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccc(cc1)Cl)/C

STK540016
Synonyms: 8- [(3- methylbutyl)sulfanyl]- 5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: CC(CCSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1)C

STK540017
Synonyms: (2E)- 3- (pyridin- 3- yl)- 2- sulfanylprop- 2- enoicacid
Smiles: OC(=O)/C(=C\c1cccnc1)/S

STK540018
Synonyms: N- [(3- cyano- 6- methyl- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)carbamothioyl]- 3- (2,6- dichlorophenyl)- 5- methyl- 1,2- oxazole- 4- carboxamide
Smiles: N#Cc1c(NC(=S)NC(=O)c2c(C)onc2c2c(Cl)cccc2Cl)sc2c1CCC(C2)C

STK540019
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1Z)- 1- (naphthalen- 2- yl)ethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C(\c1ccc2c(c1)cccc2)/C

STK540020
Synonyms: methyl4- {[3- cyano- 4,6- di(thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- 3- oxobutanoate
Smiles: COC(=O)CC(=O)CSc1nc(cc(c1C#N)c1cccs1)c1cccs1

STK540021
Synonyms: 2- {(2E)- 2- [2- (benzyloxy)benzylidene]hydrazinyl}- 4,6- dimethylpyrimidine
Smiles: Cc1cc(C)nc(n1)N/N=C/c1ccccc1OCc1ccccc1

STK540022
Synonyms: 5- (4- butoxybenzyl)- 2- {[3- (piperidin- 1- yl)propyl]amino}pyrimidine- 4,6- diol
Smiles: CCCCOc1ccc(cc1)Cc1c(O)nc(nc1O)NCCCN1CCCCC1

STK540023
Synonyms: 7- (2,3- dihydroxypropyl)- 8- [(2E)- 2- (4- fluorobenzylidene)hydrazinyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCC(Cn1c(N/N=C/c2ccc(cc2)F)nc2c1c(=O)[nH]c(=O)n2C)O

STK540024
Synonyms: 8- [(2- chlorobenzyl)sulfanyl]- 1,3- dimethyl- 7- pentyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCn1c(SCc2ccccc2Cl)nc2c1c(=O)n(c(=O)n2C)C

STK540025
Synonyms: N'- [(E)- (3,4- dimethoxyphenyl)methylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cn2cncn2)ccc1OC

STK540026
Synonyms: 2- amino- 1- (3,5- dichlorophenyl)- N- (3,4- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Clc1cc(Cl)cc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)Nc1ccc(c(c1)C)C

STK540027
Synonyms: (8S,8aR,11aS,11bS)- 8- acetyl- 10- (4- methylphenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: CC(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1C=Cc1c2cccc1)c1ccc(cc1)C

STK540028
Synonyms: 6- amino- 4- (5- bromo- 2- fluorophenyl)- 3- propyl- 4,7- dihydro[1,2]oxazolo[5,4- b]pyridine- 5- carbonitrile
Smiles: CCCc1noc2c1C(C(=C(N2)N)C#N)c1cc(Br)ccc1F

STK540029
Synonyms: N'- [1- (4- methylphenyl)- 1H- pyrazolo[3,4- d]pyrimidin- 4- yl]pyridine- 4- carbohydrazide
Smiles: Cc1ccc(cc1)n1ncc2c1ncnc2NNC(=O)c1ccncc1

STK540030
Synonyms: 2- (1,3- benzothiazol- 2- ylsulfanyl)- N'- [(E)- (3- methoxy- 4- propoxyphenyl)methylidene]acetohydrazide
Smiles: CCCOc1ccc(cc1OC)/C=N/NC(=O)CSc1nc2c(s1)cccc2

STK540031
Synonyms: 3- cyclohexyl- 11- (furan- 2- ylmethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: O=c1n(cnc2c1c1nc3ccccc3nc1n2Cc1ccco1)C1CCCCC1

STK540033
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- (3,5- dimethylpiperidin- 1- yl)ethanone
Smiles: CC1CN(CC(C1)C)CC(=O)c1c(C)[nH]c2c1ccc(c2)C

STK540034
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(1Z)- 1- (4- bromophenyl)ethylidene]acetohydrazide
Smiles: O=C(Cn1nnnc1N)N/N=C(\c1ccc(cc1)Br)/C

STK540036
Synonyms: ethyl3- [(3- cyclopentylpropanoyl)amino]- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCC1CCCC1)cc(cc2)OC

STK540037
Synonyms: 1,3- dimethyl- 7- (3- phenylpropyl)- 8- (propylamino)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCNc1nc2c(n1CCCc1ccccc1)c(=O)n(c(=O)n2C)C

STK540039
Synonyms: 8- {[benzyl(methyl)amino]methyl}- 7- hydroxy- 3- (naphthalen- 1- yl)- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CN(Cc1c(O)ccc2c1oc(c(c2=O)c1cccc2c1cccc2)C(F)(F)F)Cc1ccccc1

STK540040
Synonyms: 9- methyl- 5- (methylsulfanyl)- 3- (prop- 2- en- 1- ylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: C=CCSc1nnc2n1c(SC)nc1c2c2CCC(Cc2s1)C

STK540041
Synonyms: methyl2- {[(2- amino- 1- pentyl- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl)carbonyl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: CCCCCn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2

STK540042
Synonyms: methyl6'- amino- 1- (2- chlorobenzyl)- 5'- cyano- 2'- methyl- 2- oxo- 1,2- dihydrospiro[indole- 3,4'- pyran]- 3'- carboxylate
Smiles: COC(=O)C1=C(C)OC(=C(C21C(=O)N(c1c2cccc1)Cc1ccccc1Cl)C#N)N

STK540043
Synonyms: ethyl(2Z)- 5- (4- methoxyphenyl)- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 7- phenyl- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)C1=C(N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C/c1cn(c3c1cccc3)C)/s2)c1ccccc1

STK540044
Synonyms: N- (2,4- dichlorophenyl)- 2,2,3,3,4,4,4- heptafluorobutanamide
Smiles: Clc1ccc(c(c1)Cl)NC(=O)C(C(C(F)(F)F)(F)F)(F)F

STK540045
Synonyms: 3- benzyl- 2- {[1- oxo- 1- (piperidin- 1- yl)propan- 2- yl]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)Cc1ccccc1)SC(C(=O)N1CCCCC1)C)C

STK540048
Synonyms: methyl2- ({[2- amino- 1- (3- methylphenyl)- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl]carbonyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)C

STK540049
Synonyms: 3- benzyl- 2- {[2- (4- bromophenyl)- 2- oxoethyl]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)Cc1ccccc1)SCC(=O)c1ccc(cc1)Br)C

STK540051
Synonyms: 4- butoxy- N- (4H- 1,2,4- triazol- 4- yl)benzamide
Smiles: CCCCOc1ccc(cc1)C(=O)Nn1cnnc1

STK540052
Synonyms: N- [(3- carbamoyl- 4,5,6,7,8,9- hexahydrocycloocta[b]thiophen- 2- yl)carbamothioyl]pyridine- 4- carboxamide
Smiles: S=C(Nc1sc2c(c1C(=O)N)CCCCCC2)NC(=O)c1ccncc1

STK540053
Synonyms: 3- (4- chlorophenyl)- 5- [4- (propan- 2- yl)phenyl]- 3a,6a- dihydrospiro[furo[3,4- c]pyrrole- 1,2'- indene]- 1',3',4,6(3H,5H)- tetrone
Smiles: Clc1ccc(cc1)C1OC2(C3C1C(=O)N(C3=O)c1ccc(cc1)C(C)C)C(=O)c1c(C2=O)cccc1