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

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STK538255
Synonyms: N- (4- chlorophenyl)- 5- cyano- 6- ({2- [(2,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 1,4- dihydro- 4,4'- bipyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2C)C)NC(=C(C1c1ccncc1)C(=O)Nc1ccc(cc1)Cl)C

STK839436
Synonyms: 2- [(pyridin- 3- ylcarbonyl)amino]ethyl4- (morpholin- 4- ylsulfonyl)benzoate
Smiles: O=C(c1ccc(cc1)S(=O)(=O)N1CCOCC1)OCCNC(=O)c1cccnc1

STK839437
Synonyms: prop- 2- en- 1- yl6- ({2- [(3- chloro- 4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 2- methyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1ccc(c(c1)Cl)C

STK839438
Synonyms: 3- amino- N- (4- methoxyphenyl)- 5- oxo- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1sc2c(c1N)cc1c(n2)CCCC1=O

STK538259
Synonyms: methyl5- cyano- 6- ({2- [(3,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (2- methoxyphenyl)- 2- oxo- 1,2,3,4- tetrahydropyridine- 3- carboxylate
Smiles: COC(=O)C1C(=O)NC(=C(C1c1ccccc1OC)C#N)SCC(=O)Nc1ccc(c(c1)C)C

STK538263
Synonyms: N'- [(E)- (2,4- dichlorophenyl)methylidene]- 3- (3,5- dimethyl- 1H- pyrazol- 1- yl)propanehydrazide
Smiles: O=C(CCn1nc(cc1C)C)N/N=C/c1ccc(cc1Cl)Cl

STK538268
Synonyms: 6- [(4- chlorobenzyl)sulfanyl]- 4- (2- chlorophenyl)- 5- cyano- 2- methyl- N- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCc2ccc(cc2)Cl)NC(=C(C1c1ccccc1Cl)C(=O)Nc1ccccc1)C

STK839442
Synonyms: methyl{[3- cyano- 4- (3,4- dimethoxyphenyl)- 6- methyl- 5- (phenylcarbamoyl)pyridin- 2- yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nc(C)c(c(c1C#N)c1ccc(c(c1)OC)OC)C(=O)Nc1ccccc1

STK538269
Synonyms: ethyl4- {[(E)- (5- chloro- 2- hydroxyphenyl)methylidene]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)/N=C/c1cc(Cl)ccc1O

STK538270
Synonyms: 4,8- dichloro- 3- ethyl- 2- methylquinoline
Smiles: CCc1c(C)nc2c(c1Cl)cccc2Cl

STK538272
Synonyms: (2E)- 2- [4- (3- bromophenyl)- 1,3- thiazol- 2- yl]- 3- [(2,4,6- trimethylphenyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1c(C)cc(cc1C)C)/c1scc(n1)c1cccc(c1)Br

STK538274
Synonyms: 4- ({3- [(E)- 2- carboxyethenyl]phenyl}sulfamoyl)benzoicacid
Smiles: OC(=O)/C=C/c1cccc(c1)NS(=O)(=O)c1ccc(cc1)C(=O)O

STK538275
Synonyms: (3- ethoxy- 3- oxopropyl)[hydroxy(4- methoxyphenyl)methyl]phosphinicacid
Smiles: CCOC(=O)CCP(=O)(C(c1ccc(cc1)OC)O)O

STK839448
Synonyms: 2- {[5- acetyl- 4- (2- chlorophenyl)- 3- cyano- 6- methyl- 1,4- dihydropyridin- 2- yl]sulfanyl}- N- (1,3- thiazol- 2- yl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2nccs2)NC(=C(C1c1ccccc1Cl)C(=O)C)C

STK538279
Synonyms: N- (4- chlorophenyl)- 5- cyano- 6- ({2- [(4- ethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (4- methoxyphenyl)- 2- methylpyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2)CC)nc(c(c1c1ccc(cc1)OC)C(=O)Nc1ccc(cc1)Cl)C

STK538280
Synonyms: 5- cyano- 6- ({2- [(4- ethylphenyl)amino]- 2- oxoethyl}sulfanyl)- N- (2- methoxyphenyl)- 2- methyl- 4- (5- methylfuran- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)CC)NC(=C(C1c1ccc(o1)C)C(=O)Nc1ccccc1OC)C

STK839449
Synonyms: N- [4- chloro- 3- (trifluoromethyl)phenyl]- 4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(Nc1ccc(c(c1)C(F)(F)F)Cl)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK538284
Synonyms: 2- methoxyethyl4- (2- chlorophenyl)- 5- cyano- 6- ({2- [(2,3- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: COCCOC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1cccc(c1C)C

STK839451
Synonyms: ethyl{[3- cyano- 4- (2,3- dichlorophenyl)- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSC1=C(C(CC(=O)N1)c1cccc(c1Cl)Cl)C#N

STK538286
Synonyms: 9- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 1,2,3,4- tetrahydroacridine
Smiles: Cc1nn(c(c1)C)c1c2CCCCc2nc2c1cccc2

STK839453
Synonyms: ethyl4- {[(2,4- dioxo- 1,5- dioxaspiro[5.5]undec- 3- ylidene)methyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC=C1C(=O)OC2(OC1=O)CCCCC2

STK839454
Synonyms: propyl{[3- cyano- 4- (2,3- dichlorophenyl)- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}acetate
Smiles: CCCOC(=O)CSC1=C(C#N)C(CC(=O)N1)c1cccc(c1Cl)Cl

STK538289
Synonyms: 2- [(2- chlorobenzyl)sulfanyl]- 4- (4- methylphenyl)- 6- oxo- 1,4,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: N#CC1=C(SCc2ccccc2Cl)NC(=O)CC1c1ccc(cc1)C

STK538290
Synonyms: 6- ({2- [(4- bromophenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (4- chlorophenyl)- 5- cyano- 2- methyl- N- phenylpyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2)Br)nc(c(c1c1ccc(cc1)Cl)C(=O)Nc1ccccc1)C

STK839456
Synonyms: 3- {[(3- acetylphenyl)amino]methylidene}- 1,5- dioxaspiro[5.5]undecane- 2,4- dione
Smiles: O=C1OC2(CCCCC2)OC(=O)C1=CNc1cccc(c1)C(=O)C

STK538293
Synonyms: 5- bromo- 2- hydroxy- N- (4,5,6,7- tetrahydro- 1,3- benzothiazol- 2- yl)benzamide
Smiles: Brc1ccc(c(c1)C(=O)Nc1nc2c(s1)CCCC2)O

STK538295
Synonyms: methyl5- bromo- 3- {[2- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C(N1CCC3(CC1)OCCO3)C)cc(cc2)Br

STK538296
Synonyms: methyl5- cyano- 6- ({2- [(3,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (2- fluorophenyl)- 2- oxo- 1,2,3,4- tetrahydropyridine- 3- carboxylate
Smiles: COC(=O)C1C(=O)NC(=C(C1c1ccccc1F)C#N)SCC(=O)Nc1ccc(c(c1)C)C

STK839459
Synonyms: 3- amino- N- (4- phenoxyphenyl)- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c(c1cccs1)c1c(n2)CCCC1)Nc1ccc(cc1)Oc1ccccc1

STK839460
Synonyms: 3- amino- 7,7- dimethyl- N- (3- methylphenyl)- 5- oxo- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: Cc1cccc(c1)NC(=O)c1sc2c(c1N)cc1c(n2)CC(CC1=O)(C)C

STK839461
Synonyms: methyl4- (2- chlorophenyl)- 5- cyano- 6- ({2- [(4- ethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: COC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1ccc(cc1)CC

STK538301
Synonyms: 3,6- diamino- N- (4- chloro- 2,5- dimethoxyphenyl)- 5- cyano- 4- (3,4- dimethoxyphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cc(Cl)c(cc1NC(=O)c1sc2c(c1N)c(c1ccc(c(c1)OC)OC)c(c(n2)N)C#N)OC

STK538305
Synonyms: 6- ({2- [(4- chlorophenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (furan- 2- yl)- N- (2- methoxyphenyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Cl)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1OC)C

STK839465
Synonyms: 5- acetyl- 2- [(4- chlorobenzyl)sulfanyl]- 4- (2- chlorophenyl)- 6- methyl- 1,4- dihydropyridine- 3- carbonitrile
Smiles: N#CC1=C(SCc2ccc(cc2)Cl)NC(=C(C1c1ccccc1Cl)C(=O)C)C

STK839467
Synonyms: methyl{[3- cyano- 4- (2,3- dichlorophenyl)- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}acetate
Smiles: COC(=O)CSC1=C(C#N)C(CC(=O)N1)c1cccc(c1Cl)Cl

STK538310
Synonyms: 6- ({2- [(4- chloro- 2,5- dimethoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (3,4- dimethoxyphenyl)- 2- methyl- N- phenylpyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2cc(OC)c(cc2OC)Cl)nc(c(c1c1ccc(c(c1)OC)OC)C(=O)Nc1ccccc1)C

STK538311
Synonyms: 4- (4- chlorophenyl)- 5- cyano- 2- methyl- 6- ({2- [(2- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- N- phenylpyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2ccccc2C)nc(c(c1c1ccc(cc1)Cl)C(=O)Nc1ccccc1)C

STK538312
Synonyms: [hydroxy(phenyl)methyl](2- phenylethyl)phosphinicacid
Smiles: OC(P(=O)(CCc1ccccc1)O)c1ccccc1

STK538314
Synonyms: N- (4- chlorophenyl)- 6- ({2- [(3- chlorophenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (4- methoxyphenyl)- 2- methylpyridine- 3- carboxamide
Smiles: COc1ccc(cc1)c1c(C#N)c(SCC(=O)Nc2cccc(c2)Cl)nc(c1C(=O)Nc1ccc(cc1)Cl)C

STK538316
Synonyms: ethyl(1S,3S,3aR)- 1- (phenylcarbonyl)- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinoline- 3- carboxylate
Smiles: CCOC(=O)[C@H]1C[C@H](N2[C@@H]1C=Cc1c2cccc1)C(=O)c1ccccc1

STK538318
Synonyms: 6- ({2- [(4- chloro- 2,5- dimethoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (4- methoxyphenyl)- 2- methyl- N- phenylpyridine- 3- carboxamide
Smiles: COc1ccc(cc1)c1c(C#N)c(SCC(=O)Nc2cc(OC)c(cc2OC)Cl)nc(c1C(=O)Nc1ccccc1)C

STK538319
Synonyms: N- benzyl- 4- methyl- 6- (4- methylpiperidin- 1- yl)pyrimidin- 2- amine
Smiles: CC1CCN(CC1)c1cc(C)nc(n1)NCc1ccccc1

STK538323
Synonyms: 4- (4- chlorophenyl)- 5- cyano- 2- methyl- N- (2- methylphenyl)- 6- {[2- (naphthalen- 2- ylamino)- 2- oxoethyl]sulfanyl}pyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc3c(c2)cccc3)nc(c(c1c1ccc(cc1)Cl)C(=O)Nc1ccccc1C)C

STK538325
Synonyms: N- (4- chlorophenyl)- 5- cyano- 4- (4- methoxyphenyl)- 2- methyl- 6- {[2- oxo- 2- (phenylamino)ethyl]sulfanyl}pyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2ccccc2)nc(c(c1c1ccc(cc1)OC)C(=O)Nc1ccc(cc1)Cl)C

STK839476
Synonyms: butyl({3- cyano- 6- oxo- 4- [4- (propan- 2- yl)phenyl]- 1,4,5,6- tetrahydropyridin- 2- yl}sulfanyl)acetate
Smiles: CCCCOC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)C(C)C

STK839478
Synonyms: 3- amino- 7,7- dimethyl- N- (4- methylphenyl)- 5- oxo- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1sc2c(c1N)cc1c(n2)CC(CC1=O)(C)C

STK839480
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 2- (1,3- dioxo- 1H- benzo[de]isoquinolin- 2(3H)- yl)acetamide
Smiles: COc1cc(CCNC(=O)Cn2c(=O)c3cccc4c3c(c2=O)ccc4)ccc1OC

STK538328
Synonyms: diethyl(acetylamino)[4- (diphenylphosphoryl)butyl]propanedioate
Smiles: CCOC(=O)C(C(=O)OCC)(NC(=O)C)CCCCP(=O)(c1ccccc1)c1ccccc1

STK538329
Synonyms: 2- methyl- N- (phenylacetyl)glutamicacid
Smiles: O=C(Cc1ccccc1)NC(C(=O)O)(CCC(=O)O)C

STK839483
Synonyms: prop- 2- en- 1- yl5- cyano- 6- ({2- [(2,5- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1cc(C)ccc1C

STK538334
Synonyms: 2,2- dimethyl- 5- [(1,3- thiazol- 2- ylamino)methylidene]- 1,3- dioxane- 4,6- dione
Smiles: O=C1OC(C)(C)OC(=O)C1=CNc1nccs1

STK839485
Synonyms: N'- [(E)- (2,5- dimethoxyphenyl)methylidene]- 1- methyl- 1H- indole- 3- carbohydrazide
Smiles: COc1ccc(cc1/C=N/NC(=O)c1cn(c2c1cccc2)C)OC

STK538336
Synonyms: ethyl4- (2- chlorophenyl)- 5- cyano- 6- ({2- oxo- 2- [(2,4,6- trimethylphenyl)amino]ethyl}sulfanyl)- 2- propyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: CCCC1=C(C(=O)OCC)C(C(=C(N1)SCC(=O)Nc1c(C)cc(cc1C)C)C#N)c1ccccc1Cl

STK538338
Synonyms: N- (2,4- dimethoxyphenyl)- 2- (3- nitrophenyl)quinazolin- 4- amine
Smiles: COc1ccc(c(c1)OC)Nc1nc(nc2c1cccc2)c1cccc(c1)[N+](=O)[O-]

STK538339
Synonyms: 5- cyano- 4- (4- ethoxyphenyl)- 6- ({2- [(4- ethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N- phenylpyridine- 3- carboxamide
Smiles: CCOc1ccc(cc1)c1c(C#N)c(SCC(=O)Nc2ccc(cc2)CC)nc(c1C(=O)Nc1ccccc1)C

STK839486
Synonyms: 3,6- diamino- 5- cyano- 4- (3,4- dimethoxyphenyl)- N- (4- ethylphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: CCc1ccc(cc1)NC(=O)c1sc2c(c1N)c(c1ccc(c(c1)OC)OC)c(c(n2)N)C#N

STK538340
Synonyms: 5,7- dibromoquinolin- 8- yl2,4- dimethylbenzenesulfonate
Smiles: Cc1ccc(c(c1)C)S(=O)(=O)Oc1c(Br)cc(c2c1nccc2)Br

STK538341
Synonyms: 2- [4- (diphenylmethyl)piperazin- 1- yl]- 1- (5- methoxy- 1H- indol- 3- yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCN(CC1)C(c1ccccc1)c1ccccc1

STK538342
Synonyms: 1- ethyl- N- (6- fluoro- 1,3- benzothiazol- 2- yl)- 4- hydroxy- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCn1c(=O)c(C(=O)Nc2sc3c(n2)ccc(c3)F)c(c2c1cccc2)O

STK538343
Synonyms: tert- butyl6- ({2- [(4- chloro- 2,5- dimethoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (4- chlorophenyl)- 5- cyano- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2cc(OC)c(cc2OC)Cl)NC(=C(C1c1ccc(cc1)Cl)C(=O)OC(C)(C)C)C

STK839490
Synonyms: 3- amino- N- (4- bromophenyl)- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: Brc1ccc(cc1)NC(=O)c1sc2c(c1N)c(c1cccs1)c1c(n2)CCCC1

STK839491
Synonyms: 2- ({3- cyano- 6- oxo- 4- [4- (propan- 2- yl)phenyl]- 1,4,5,6- tetrahydropyridin- 2- yl}sulfanyl)- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)C(C)C

STK839492
Synonyms: 2- (3- methoxyphenyl)- 5- phenyl- 4- (thiophen- 2- yl)- 1H- imidazole
Smiles: COc1cccc(c1)c1[nH]c(c(n1)c1cccs1)c1ccccc1

STK538345
Synonyms: 1- methyl- 4- (4- methylpiperazin- 1- yl)[1,2,4]triazolo[4,3- a]quinoxaline
Smiles: CN1CCN(CC1)c1nc2ccccc2n2c1nnc2C

STK538346
Synonyms: 2- {[4- (4- chlorophenyl)- 3- cyano- 5- oxo- 1,4,5,6,7,8- hexahydroquinolin- 2- yl]sulfanyl}- N- (naphthalen- 2- yl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc3c(c2)cccc3)NC2=C(C1c1ccc(cc1)Cl)C(=O)CCC2

STK538347
Synonyms: N- [4- ({[4- phenyl- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)phenyl]benzenesulfonamide
Smiles: O=C(c1ccc(cc1)NS(=O)(=O)c1ccccc1)CSc1nnc(n1c1ccccc1)c1ccncc1

STK839494
Synonyms: 6- ({2- [(3- chloro- 2- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (furan- 2- yl)- 2- methyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2C)Cl)NC(=C(C1c1ccco1)C(=O)N)C

STK839495
Synonyms: 4- bromo- 2- [5- phenyl- 4- (thiophen- 2- yl)- 1H- imidazol- 2- yl]phenol
Smiles: Brc1ccc(c(c1)c1[nH]c(c(n1)c1cccs1)c1ccccc1)O

STK538349
Synonyms: 3,6- diamino- N- (3- chloro- 4- methylphenyl)- 5- cyano- 4- [4- (propan- 2- yl)phenyl]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: N#Cc1c(N)nc2c(c1c1ccc(cc1)C(C)C)c(N)c(s2)C(=O)Nc1ccc(c(c1)Cl)C

STK839496
Synonyms: prop- 2- en- 1- yl6- ({2- [(5- chloro- 2- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 2- methyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1cc(Cl)ccc1C

STK839498
Synonyms: 3- amino- 4- (thiophen- 2- yl)- N- (2,4,6- trimethylphenyl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: Cc1cc(C)c(c(c1)C)NC(=O)c1sc2c(c1N)c(c1cccs1)c1c(n2)CCCC1

STK538353
Synonyms: 3- ({2- [(4- methylquinolin- 2- yl)amino]ethyl}amino)cyclohex- 2- en- 1- one
Smiles: O=C1CCCC(=C1)NCCNc1cc(C)c2c(n1)cccc2

STK839502
Synonyms: prop- 2- en- 1- yl5- cyano- 4- (furan- 2- yl)- 2- methyl- 6- ({2- [(4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1ccc(cc1)C

STK839504
Synonyms: 5- [(1,3- benzodioxol- 5- ylamino)methylidene]- 2,2- dimethyl- 1,3- dioxane- 4,6- dione
Smiles: O=C1OC(C)(C)OC(=O)C1=CNc1ccc2c(c1)OCO2

STK538354
Synonyms: 3- amino- N- (3,4- dichlorophenyl)- 4- [4- (propan- 2- yl)phenyl]- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: CC(c1ccc(cc1)c1c2CCCCc2nc2c1c(N)c(s2)C(=O)Nc1ccc(c(c1)Cl)Cl)C

STK538356
Synonyms: 3- [3- (3,4- dimethoxyphenyl)propyl]- 8- fluoro- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cc(CCCn2cnc3c(c2=O)[nH]c2c3cc(cc2)F)ccc1OC

STK538357
Synonyms: hexyl3- (1,4- dioxo- 3,4- dihydrophthalazin- 2(1H)- yl)propanoate
Smiles: CCCCCCOC(=O)CCn1[nH]c(=O)c2c(c1=O)cccc2

STK538359
Synonyms: 1- (5- methoxy- 1H- indol- 3- yl)- 2- (1,3- thiazol- 2- ylamino)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CNc1nccs1

STK538361
Synonyms: 6- ({2- [(5- chloro- 2- methoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- N- (4- chlorophenyl)- 5- cyano- 2- methyl- 4- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(Cl)ccc2OC)NC(=C(C1c1ccccc1)C(=O)Nc1ccc(cc1)Cl)C

STK839507
Synonyms: N- (4- {[(2,4- dioxo- 1,5- dioxaspiro[5.5]undec- 3- ylidene)methyl]amino}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)NC=C1C(=O)OC2(OC1=O)CCCCC2

STK839509
Synonyms: 2- amino- 4- (4- ethoxyphenyl)- 6- {[2- (4- methoxyphenyl)- 2- oxoethyl]sulfanyl}pyridine- 3,5- dicarbonitrile
Smiles: CCOc1ccc(cc1)c1c(C#N)c(SCC(=O)c2ccc(cc2)OC)nc(c1C#N)N

STK538364
Synonyms: [3- (diphenylphosphoryl)propyl](2- phenylethyl)phosphinicacid
Smiles: OP(=O)(CCc1ccccc1)CCCP(=O)(c1ccccc1)c1ccccc1

STK839513
Synonyms: 2- ({3- cyano- 6- oxo- 4- [4- (propan- 2- yl)phenyl]- 1,4,5,6- tetrahydropyridin- 2- yl}sulfanyl)- N- [4- (propan- 2- yl)phenyl]acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C(C)C)NC(=O)CC1c1ccc(cc1)C(C)C

STK839514
Synonyms: N- (4- methylphenyl)- 2- [3- (morpholin- 4- ylmethyl)- 2,4- dioxo- 1,3- thiazolidin- 5- yl]acetamide
Smiles: O=C(CC1SC(=O)N(C1=O)CN1CCOCC1)Nc1ccc(cc1)C

STK538366
Synonyms: prop- 2- en- 1- yl6- ({2- [(4- bromophenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 2- methyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1ccc(cc1)Br

STK839515
Synonyms: 2- hydroxy- N- (4,5,6,7- tetrahydro- 1,3- benzothiazol- 2- yl)benzamide
Smiles: O=C(c1ccccc1O)Nc1nc2c(s1)CCCC2

STK839516
Synonyms: prop- 2- en- 1- yl6- ({2- [(4- chlorophenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (furan- 2- yl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1ccc(cc1)Cl

STK839517
Synonyms: methyl6- ({2- [(4- acetylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (2- chlorophenyl)- 5- cyano- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: COC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1ccc(cc1)C(=O)C

STK839518
Synonyms: benzyl6- [(2- amino- 2- oxoethyl)sulfanyl]- 4- (4- chlorophenyl)- 5- cyano- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: N#CC1=C(SCC(=O)N)NC(=C(C1c1ccc(cc1)Cl)C(=O)OCc1ccccc1)C

STK839519
Synonyms: 6- [(2- chlorobenzyl)sulfanyl]- 5- cyano- 4- (furan- 2- yl)- 2- methyl- N- phenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCc2ccccc2Cl)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C

STK538368
Synonyms: (3bS,4aR)- 1- (1,3- benzothiazol- 2- yl)- 3,4,4- trimethyl- 3b,4,4a,5- tetrahydro- 1H- cyclopropa[3,4]cyclopenta[1,2- c]pyrazole
Smiles: Cc1nn(c2c1[C@H]1[C@@H](C2)C1(C)C)c1nc2c(s1)cccc2

STK839520
Synonyms: 1- (4- methoxyphenyl)- 2- {[5- (4- methoxyphenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}ethanone
Smiles: COc1ccc(cc1)C(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)OC

STK538371
Synonyms: 3- {(1Z)- 1- [(2Z)- (3,3- dimethyl- 3,4- dihydroisoquinolin- 1(2H)- ylidene)hydrazinylidene]ethyl}- 4- hydroxy- 6- methyl- 2H- pyran- 2- one
Smiles: Cc1cc(O)c(c(=O)o1)/C(=N\N=C\1/NC(C)(C)Cc2c1cccc2)/C

STK538373
Synonyms: 6- [(2- chlorobenzyl)sulfanyl]- 4- (2- chlorophenyl)- 5- cyano- N- (2- methoxyphenyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCc2ccccc2Cl)NC(=C(C1c1ccccc1Cl)C(=O)Nc1ccccc1OC)C

STK839522
Synonyms: 2- {[5- acetyl- 4- (2- chlorophenyl)- 3- cyano- 6- methyl- 1,4- dihydropyridin- 2- yl]sulfanyl}- N- (4- fluorophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)F)NC(=C(C1c1ccccc1Cl)C(=O)C)C

STK839523
Synonyms: 5,5,8,9- tetramethyl- 5,6- dihydrotetrazolo[5,1- a]isoquinoline
Smiles: Cc1cc2c(cc1C)CC(n1c2nnn1)(C)C

STK538376
Synonyms: N~2~- benzyl- 6- methyl- N~4~- phenylpyrimidine- 2,4- diamine
Smiles: Cc1nc(NCc2ccccc2)nc(c1)Nc1ccccc1

STK839525
Synonyms: 3- {[(2- ethoxyphenyl)amino]methylidene}- 1,5- dioxaspiro[5.5]undecane- 2,4- dione
Smiles: CCOc1ccccc1NC=C1C(=O)OC2(OC1=O)CCCCC2

STK839526
Synonyms: 2- [(3,3- dimethyl- 3,4- dihydroisoquinolin- 1- yl)methyl]- 1,1,1,3,3,3- hexafluoropropan- 2- ol
Smiles: CC1(C)Cc2ccccc2C(=N1)CC(C(F)(F)F)(C(F)(F)F)O

STK839527
Synonyms: methyl4- (2- chlorophenyl)- 5- cyano- 6- ({2- [(3- methoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: COc1cccc(c1)NC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)OC)c1ccccc1Cl

STK538382
Synonyms: ethyl3- {[2- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl)propanoyl]amino}- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C(N1CCC3(CC1)OCCO3)C)cc(cc2)F

STK839528
Synonyms: 6- methyl- 5- (2- methylprop- 2- en- 1- yl)- 2- sulfanylpyrimidin- 4(3H)- one
Smiles: CC(=C)Cc1c(C)nc([nH]c1=O)S

STK839529
Synonyms: 1- (2- chlorophenoxy)- 3- (3,6- dichloro- 9H- carbazol- 9- yl)propan- 2- ol
Smiles: OC(Cn1c2ccc(cc2c2c1ccc(c2)Cl)Cl)COc1ccccc1Cl

STK538393
Synonyms: methyl2- [(3- {[(4- methylphenyl)sulfonyl]amino}quinoxalin- 2- yl)amino]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccc(cc2)C)sc2c1CCCC2

STK538400
Synonyms: 11- hexyl- 3- [3- (morpholin- 4- yl)propyl]- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCCCn1c2ncn(c(=O)c2c2c1nc1ccccc1n2)CCCN1CCOCC1

STK839531
Synonyms: 2- ({3- cyano- 5- oxo- 4- [2- (trifluoromethyl)phenyl]- 1,4,5,6,7,8- hexahydroquinolin- 2- yl}sulfanyl)- N- (3,4- dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)C)C)NC2=C(C1c1ccccc1C(F)(F)F)C(=O)CCC2

STK839532
Synonyms: 3- ({[4- chloro- 2- (trifluoromethyl)phenyl]amino}methylidene)- 1,5- dioxaspiro[5.5]undecane- 2,4- dione
Smiles: Clc1ccc(c(c1)C(F)(F)F)NC=C1C(=O)OC2(OC1=O)CCCCC2

STK538402
Synonyms: 3- amino- N- (4- bromophenyl)- 4- [4- (propan- 2- yl)phenyl]- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: Brc1ccc(cc1)NC(=O)c1sc2c(c1N)c(c1ccc(cc1)C(C)C)c1c(n2)CCCC1

STK839536
Synonyms: methyl4- (2- chlorophenyl)- 5- cyano- 2- methyl- 6- ({2- oxo- 2- [(2,4,6- trimethylphenyl)amino]ethyl}sulfanyl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: COC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1c(C)cc(cc1C)C

STK839538
Synonyms: prop- 2- en- 1- yl5- cyano- 2- methyl- 6- ({2- [(3- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1cccc(c1)C

STK839539
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 2- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 6- oxo- 1,4,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: N#CC1=C(SCC(=C)C)NC(=O)CC1c1ccc2c(c1)OCO2

STK839540
Synonyms: 3- amino- N- (2,5- dimethylphenyl)- 4- (furan- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: Cc1ccc(c(c1)NC(=O)c1sc2c(c1N)c(c1ccco1)c1c(n2)CCCC1)C

STK538409
Synonyms: 2- (1- methyl- 3- phenyl- 1H- 1,2,4- triazol- 5- yl)phenol
Smiles: Cn1nc(nc1c1ccccc1O)c1ccccc1

STK538410
Synonyms: 3,3,6,7- tetramethyl- N- (1,3- thiazol- 2- yl)- 3,4- dihydroisoquinolin- 1- amine
Smiles: Cc1cc2CC(C)(C)N=C(c2cc1C)Nc1nccs1

STK538413
Synonyms: ethyl4- (2- chlorophenyl)- 5- cyano- 6- ({2- [(3,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- propyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: CCOC(=O)C1=C(CCC)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1ccc(c(c1)C)C

STK538414
Synonyms: N- [(1E,2E)- 3- phenylprop- 2- en- 1- ylidene]- 1H- benzimidazol- 1- amine
Smiles: c1ccc(cc1)/C=C/C=N/n1cnc2c1cccc2

STK839542
Synonyms: 2- {[(4- chloro- 2,5- dimethoxyphenyl)amino]methylidene}- 5,5- dimethylcyclohexane- 1,3- dione
Smiles: COc1cc(Cl)c(cc1NC=C1C(=O)CC(CC1=O)(C)C)OC

STK538415
Synonyms: 6- ({2- [(3- chloro- 4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- N- (4- chlorophenyl)- 5- cyano- 2- methyl- 1,4- dihydro- 4,4'- bipyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)C)NC(=C(C1c1ccncc1)C(=O)Nc1ccc(cc1)Cl)C

STK538419
Synonyms: N- (4- methoxyphenyl)- 2- (3- nitrophenyl)quinazolin- 4- amine
Smiles: COc1ccc(cc1)Nc1nc(nc2c1cccc2)c1cccc(c1)[N+](=O)[O-]

STK839546
Synonyms: 6- ({2- [(5- chloro- 2- methoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (furan- 2- yl)- 2- methyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(Cl)ccc2OC)NC(=C(C1c1ccco1)C(=O)N)C

STK538421
Synonyms: 6- ({2- [(3- chlorophenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (3,4- dimethoxyphenyl)- 2- methyl- N- phenylpyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2cccc(c2)Cl)nc(c(c1c1ccc(c(c1)OC)OC)C(=O)Nc1ccccc1)C

STK839547
Synonyms: 3- {[(2- nitrophenyl)amino]methylidene}- 1,5- dioxaspiro[5.5]undecane- 2,4- dione
Smiles: O=C1OC2(CCCCC2)OC(=O)C1=CNc1ccccc1[N+](=O)[O-]

STK839549
Synonyms: benzyl3- amino- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxylate
Smiles: O=C(c1sc2c(c1N)c(c1cccs1)c1c(n2)CCCC1)OCc1ccccc1

STK839551
Synonyms: 1- (3,4- dimethoxyphenyl)- 11,11- dimethyl- 10,11- dihydrobenzo[f][1,2,4]triazolo[3,4- a]isoquinoline
Smiles: COc1cc(ccc1OC)c1nnc2n1C(C)(C)Cc1c2ccc2c1cccc2

STK839552
Synonyms: benzyl3- amino- 4- (furan- 2- yl)- 6- phenylthieno[2,3- b]pyridine- 2- carboxylate
Smiles: O=C(c1sc2c(c1N)c(cc(n2)c1ccccc1)c1ccco1)OCc1ccccc1

STK538423
Synonyms: methyl5- cyano- 4- (4- ethoxyphenyl)- 6- (methylsulfanyl)- 2- oxo- 1,2,3,4- tetrahydropyridine- 3- carboxylate
Smiles: CCOc1ccc(cc1)C1C(C(=O)OC)C(=O)NC(=C1C#N)SC

STK839554
Synonyms: (5Z)- 2- (4- acetylpiperazin- 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)C(=O)C

STK839557
Synonyms: methyl4- (2- chlorophenyl)- 5- cyano- 2- methyl- 6- ({2- [(4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: COC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1ccc(cc1)C

STK538429
Synonyms: 5- cyano- 4- (3,4- dimethoxyphenyl)- 6- ({2- [(3,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N- phenylpyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(c(c2)C)C)nc(c(c1c1ccc(c(c1)OC)OC)C(=O)Nc1ccccc1)C

STK839558
Synonyms: 2- (3- nitrophenyl)- 4- (pyrrolidin- 1- yl)quinazoline
Smiles: [O-][N+](=O)c1cccc(c1)c1nc2ccccc2c(n1)N1CCCC1

STK538432
Synonyms: N- {(1E)- 1- [(1S,5R)- 6,6- dimethyl- 3- oxobicyclo[3.1.0]hex- 2- ylidene]ethyl}thiophene- 2- carboxamide
Smiles: C/C(=C/1\C(=O)C[C@@H]2[C@H]1C2(C)C)/NC(=O)c1cccs1

STK538433
Synonyms: benzyl4- (4- chlorophenyl)- 5- cyano- 6- ({2- [(2,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2C)C)NC(=C(C1c1ccc(cc1)Cl)C(=O)OCc1ccccc1)C

STK538435
Synonyms: 7- methyl- 1,2,3,4- tetrahydrocyclopenta[b]indole- 3- carbonitrile
Smiles: N#CC1CCc2c1[nH]c1c2cc(cc1)C

STK839562
Synonyms: prop- 2- en- 1- yl5- cyano- 6- ({2- [(3,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1ccc(c(c1)C)C

STK538436
Synonyms: 3- {4- [(5Z)- 5- {[5- (4- bromophenyl)furan- 2- yl]methylidene}- 4- oxo- 4,5- dihydro- 1,3- thiazol- 2- yl]piperazin- 1- yl}propanenitrile
Smiles: N#CCCN1CCN(CC1)C1=NC(=O)/C(=C/c2ccc(o2)c2ccc(cc2)Br)/S1

STK839563
Synonyms: prop- 2- en- 1- yl6- ({2- [(3- acetylphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 2- methyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1cccc(c1)C(=O)C

STK538438
Synonyms: 2- methyl- N- [3- (morpholin- 4- yl)propyl]- 11- oxo- 5,6,7,8,9,11- hexahydrothieno[3',2':4,5]pyrimido[1,2- a]azepine- 3- carboxamide
Smiles: O=C(c1c(C)sc2c1nc1CCCCCn1c2=O)NCCCN1CCOCC1

STK538439
Synonyms: N- [3- (2,6- dimethylmorpholin- 4- yl)quinoxalin- 2- yl]- 2- methylbenzenesulfonamide
Smiles: CC1OC(C)CN(C1)c1nc2ccccc2nc1NS(=O)(=O)c1ccccc1C

STK839566
Synonyms: methyl{[3- cyano- 4- (2- fluorophenyl)- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}acetate
Smiles: COC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccccc1F

STK839567
Synonyms: 2- methoxyethyl4- (2- chlorophenyl)- 5- cyano- 6- ({2- [(2- ethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: COCCOC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1ccccc1CC

STK839569
Synonyms: 2- {[3- cyano- 4- (2- methylphenyl)- 5- oxo- 1,4,5,6,7,8- hexahydroquinolin- 2- yl]sulfanyl}- N- (2- methylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2C)NC2=C(C1c1ccccc1C)C(=O)CCC2

STK538443
Synonyms: 5- [(1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)sulfamoyl]- 2- methoxybenzoicacid
Smiles: COc1ccc(cc1C(=O)O)S(=O)(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C

STK538445
Synonyms: 6- ({2- [(4- chloro- 2,5- dimethoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- N- (4- chlorophenyl)- 5- cyano- 4- (4- methoxyphenyl)- 2- methylpyridine- 3- carboxamide
Smiles: COc1ccc(cc1)c1c(C#N)c(SCC(=O)Nc2cc(OC)c(cc2OC)Cl)nc(c1C(=O)Nc1ccc(cc1)Cl)C

STK839570
Synonyms: 2- [3- (1,3- benzoxazol- 2- ylsulfanyl)propyl]- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C1N(CCCSc2nc3c(o2)cccc3)C(=O)c2c1cccc2

STK538449
Synonyms: 5- cyano- 6- ({2- [(2,5- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N,4- diphenyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(C)ccc2C)NC(=C(C1c1ccccc1)C(=O)Nc1ccccc1)C

STK538450
Synonyms: 2- {[5- (3- chloro- 6- methoxy- 1- benzothiophen- 2- yl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (4- chlorophenyl)ethanone
Smiles: COc1ccc2c(c1)sc(c2Cl)c1nnc(n1c1ccccc1)SCC(=O)c1ccc(cc1)Cl

STK839573
Synonyms: prop- 2- en- 1- yl6- ({2- [(3- chloro- 2- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 2- methyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1cccc(c1C)Cl

STK538455
Synonyms: ethyl1- {[(5E)- 5- (4- methoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]methyl}piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CN1C(=S)S/C(=C/c2ccc(cc2)OC)/C1=O

STK839578
Synonyms: 3- amino- N- (3- chlorophenyl)- 4- (furan- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: Clc1cccc(c1)NC(=O)c1sc2c(c1N)c(c1ccco1)c1c(n2)CCCC1

STK538458
Synonyms: 6- ({2- [(4- chloro- 2,5- dimethoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (4- chlorophenyl)- 5- cyano- 2- methyl- N- (2- methylphenyl)pyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2cc(OC)c(cc2OC)Cl)nc(c(c1c1ccc(cc1)Cl)C(=O)Nc1ccccc1C)C

STK839580
Synonyms: [3- amino- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinolin- 2- yl](4- chlorophenyl)methanone
Smiles: Clc1ccc(cc1)C(=O)c1sc2c(c1N)c(c1cccs1)c1c(n2)CCCC1

STK538461
Synonyms: benzyl4- (4- chlorophenyl)- 5- cyano- 2- methyl- 6- ({2- [(4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C)NC(=C(C1c1ccc(cc1)Cl)C(=O)OCc1ccccc1)C

STK538466
Synonyms: 8,9- dimethoxy- 3,5,5- trimethyl- 5,6- dihydro[1,2,4]triazolo[3,4- a]isoquinoline
Smiles: COc1cc2c(cc1OC)CC(n1c2nnc1C)(C)C

STK839583
Synonyms: 2- {[3- cyano- 4- (5- methylfuran- 2- yl)- 5- oxo- 1,4,5,6,7,8- hexahydroquinolin- 2- yl]sulfanyl}- N- (2,3- dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2C)C)NC2=C(C1c1ccc(o1)C)C(=O)CCC2

STK538469
Synonyms: 6- ({2- [(3- chloro- 4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (4- methoxyphenyl)- 2- methyl- N- phenylpyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(c(c2)Cl)C)nc(c(c1c1ccc(cc1)OC)C(=O)Nc1ccccc1)C

STK839584
Synonyms: prop- 2- en- 1- yl5- cyano- 6- ({2- [(2,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (furan- 2- yl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1ccc(cc1C)C

STK538470
Synonyms: 4- (4- chlorophenyl)- 5- cyano- 2- methyl- 6- (methylsulfanyl)- N- phenylpyridine- 3- carboxamide
Smiles: N#Cc1c(SC)nc(c(c1c1ccc(cc1)Cl)C(=O)Nc1ccccc1)C

STK839586
Synonyms: prop- 2- en- 1- yl6- ({2- [(3- chloro- 4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (furan- 2- yl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1ccc(c(c1)Cl)C

STK839587
Synonyms: N- [3- (9H- carbazol- 9- yl)- 2- hydroxypropyl]- N- (furan- 2- ylmethyl)methanesulfonamide
Smiles: OC(CN(S(=O)(=O)C)Cc1ccco1)Cn1c2ccccc2c2c1cccc2

STK538472
Synonyms: 2- [(3,4- dimethoxyphenyl)(phenyl)methyl]- 5- methylfuran
Smiles: COc1ccc(cc1OC)C(c1ccc(o1)C)c1ccccc1

STK839591
Synonyms: ethyl5- acetyl- 2- {[4- (1,3- dioxo- 1H- benzo[de]isoquinolin- 2(3H)- yl)butanoyl]amino}- 4- methylthiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CCCn2c(=O)c3cccc4c3c(c2=O)ccc4)sc(c1C)C(=O)C

STK538473
Synonyms: 6- ({2- [(4- bromophenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- N- (2- methoxyphenyl)- 2- methyl- 4- (5- methylfuran- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Br)NC(=C(C1c1ccc(o1)C)C(=O)Nc1ccccc1OC)C

STK839595
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 2- (ethylsulfanyl)- 6- oxo- 1,4,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: CCSC1=C(C#N)C(CC(=O)N1)c1ccc2c(c1)OCO2

STK538477
Synonyms: 2- (benzylsulfanyl)- 4- (2,3- dichlorophenyl)- 6- oxo- 1,4,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: N#CC1=C(SCc2ccccc2)NC(=O)CC1c1cccc(c1Cl)Cl

STK839596
Synonyms: 3- amino- N- (4- ethylphenyl)- 7,7- dimethyl- 5- oxo- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: CCc1ccc(cc1)NC(=O)c1sc2c(c1N)cc1c(n2)CC(CC1=O)(C)C

STK839598
Synonyms: 3- amino- 4- (3,4- dimethoxyphenyl)- 6- methyl- N- phenyl- 2- (phenylcarbonyl)thieno[2,3- b]pyridine- 5- carboxamide
Smiles: COc1ccc(cc1OC)c1c(C(=O)Nc2ccccc2)c(C)nc2c1c(N)c(s2)C(=O)c1ccccc1

STK538479
Synonyms: ethyl3- {[2- (2,6- dimethylmorpholin- 4- yl)propanoyl]amino}- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C(N1CC(C)OC(C1)C)C)cc(cc2)F

STK839600
Synonyms: 1- (3,6- dibromo- 9H- carbazol- 9- yl)- 3- [(2,4- dimethylphenyl)amino]propan- 2- ol
Smiles: Cc1ccc(c(c1)C)NCC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)O

STK538481
Synonyms: N- (4- chlorophenyl)- 5- cyano- 6- ({2- [(3,4- dichlorophenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 1,4- dihydro- 4,4'- bipyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)Cl)NC(=C(C1c1ccncc1)C(=O)Nc1ccc(cc1)Cl)C

STK839601
Synonyms: prop- 2- en- 1- yl5- cyano- 6- {[2- (4- methoxyphenyl)- 2- oxoethyl]sulfanyl}- 2- methyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)c1ccc(cc1)OC

STK538483
Synonyms: 6- (butylsulfanyl)- 4- (4- chlorophenyl)- 5- cyano- 2- methyl- N- phenylpyridine- 3- carboxamide
Smiles: CCCCSc1nc(C)c(c(c1C#N)c1ccc(cc1)Cl)C(=O)Nc1ccccc1

STK538485
Synonyms: methyl5- cyano- 4- (4- methylphenyl)- 2- oxo- 6- (prop- 2- en- 1- ylsulfanyl)- 1,2,3,4- tetrahydropyridine- 3- carboxylate
Smiles: C=CCSC1=C(C#N)C(C(C(=O)N1)C(=O)OC)c1ccc(cc1)C

STK839604
Synonyms: N- benzyl- 4- methyl- 6- (piperidin- 1- yl)pyrimidin- 2- amine
Smiles: Cc1nc(NCc2ccccc2)nc(c1)N1CCCCC1

STK538487
Synonyms: 2- ({3- cyano- 6- oxo- 4- [4- (propan- 2- yl)phenyl]- 1,4,5,6- tetrahydropyridin- 2- yl}sulfanyl)- N- (naphthalen- 2- yl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc3c(c2)cccc3)NC(=O)CC1c1ccc(cc1)C(C)C

STK538488
Synonyms: 2- (butylsulfanyl)- 4- (2- chlorophenyl)- 6- phenyl- 1,4- dihydropyridine- 3,5- dicarbonitrile
Smiles: CCCCSC1=C(C#N)C(C(=C(N1)c1ccccc1)C#N)c1ccccc1Cl

STK538490
Synonyms: 4- amino- 6- methyl- 5- phenyl- 5H- pyrrolo[3,2- d]pyrimidine- 7- carbonitrile
Smiles: N#Cc1c(C)n(c2c1ncnc2N)c1ccccc1

STK839605
Synonyms: 5- cyano- 6- ({2- [(2,5- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (furan- 2- yl)- 2- methyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(C)ccc2C)NC(=C(C1c1ccco1)C(=O)N)C

STK538491
Synonyms: 2- nitro- N'- (4'H- spiro[cyclopentane- 1,3'- isoquinolin]- 1'- yl)benzohydrazide
Smiles: [O-][N+](=O)c1ccccc1C(=O)NNC1=NC2(CCCC2)Cc2c1cccc2

STK538493
Synonyms: methyl6- ({2- [(3- chloro- 2- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (2- chlorophenyl)- 5- cyano- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2C)Cl)NC(=C(C1c1ccccc1Cl)C(=O)OC)C

STK839606
Synonyms: N- (4- chlorophenyl)- 2- {[3- cyano- 4- (furan- 2- yl)- 5,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2)Cl)nc2c(c1c1ccco1)CCCC2

STK538494
Synonyms: 4- {[(E)- 3,4- dihydro- 2H- 1,5- benzodioxepin- 6- ylmethylidene]amino}- 1,5- dimethyl- 2- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: Cc1c(/N=C/c2cccc3c2OCCCO3)c(=O)n(n1C)c1ccccc1

STK839607
Synonyms: 6- (butylsulfanyl)- 4- (2- ethoxyphenyl)- 2- oxo- 1,2,3,4- tetrahydropyridine- 3,5- dicarbonitrile
Smiles: CCCCSC1=C(C#N)C(C(C(=O)N1)C#N)c1ccccc1OCC

STK538495
Synonyms: methyl6- [(2- chlorobenzyl)sulfanyl]- 5- cyano- 4- (4- ethoxyphenyl)- 2- oxo- 1,2,3,4- tetrahydropyridine- 3- carboxylate
Smiles: CCOc1ccc(cc1)C1C(C(=O)OC)C(=O)NC(=C1C#N)SCc1ccccc1Cl

STK839609
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 4- (2- methylphenyl)- 6- oxo- 1,4,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: N#CC1=C(SCc2ccc(cc2)Cl)NC(=O)CC1c1ccccc1C

STK839610
Synonyms: 2- {[3- cyano- 4- (2,4- dichlorophenyl)- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}- N- (2,3- dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2C)C)NC(=O)CC1c1ccc(cc1Cl)Cl

STK839611
Synonyms: methyl4- (2- chlorophenyl)- 5- cyano- 6- ({2- [(2- ethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: COC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1ccccc1CC

STK839612
Synonyms: 2- {[3- cyano- 4- (2- methylphenyl)- 5- oxo- 1,4,5,6,7,8- hexahydroquinolin- 2- yl]sulfanyl}- N- (2,5- dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(C)ccc2C)NC2=C(C1c1ccccc1C)C(=O)CCC2

STK538502
Synonyms: methyl5- cyano- 4- (4- methylphenyl)- 6- (methylsulfanyl)- 2- oxo- 1,2,3,4- tetrahydropyridine- 3- carboxylate
Smiles: COC(=O)C1C(=O)NC(=C(C1c1ccc(cc1)C)C#N)SC

STK839613
Synonyms: 4- (2- chlorophenyl)- 2- [(3- cyanopropyl)sulfanyl]- 6- oxo- 1,4,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: N#CCCCSC1=C(C#N)C(CC(=O)N1)c1ccccc1Cl

STK538508
Synonyms: 2- ({4- [4- (benzyloxy)phenyl]- 3- cyano- 5- oxo- 1,4,5,6,7,8- hexahydroquinolin- 2- yl}sulfanyl)- N- (3,4- dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)C)C)NC2=C(C1c1ccc(cc1)OCc1ccccc1)C(=O)CCC2

STK839618
Synonyms: prop- 2- en- 1- yl5- cyano- 6- ({2- [(4- ethoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (furan- 2- yl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1ccc(cc1)OCC

STK538511
Synonyms: 4- (diphenylphosphoryl)isovaline
Smiles: OC(=O)C(CCP(=O)(c1ccccc1)c1ccccc1)(N)C

STK839621
Synonyms: N~2~- benzyl- N~4~- cyclohexyl- 6- methylpyrimidine- 2,4- diamine
Smiles: Cc1cc(NC2CCCCC2)nc(n1)NCc1ccccc1

STK839622
Synonyms: prop- 2- en- 1- yl5- cyano- 2- methyl- 6- ({2- oxo- 2- [(2,4,6- trimethylphenyl)amino]ethyl}sulfanyl)- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1c(C)cc(cc1C)C

STK839624
Synonyms: 3- amino- N- (4- chlorophenyl)- 4- (furan- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1sc2c(c1N)c(c1ccco1)c1c(n2)CCCC1

STK538518
Synonyms: (2Z)- 2- cyano- 3- (dimethylamino)- N- [3- (morpholin- 4- yl)propyl]but- 2- enamide
Smiles: CN(/C(=C(\C(=O)NCCCN1CCOCC1)/C#N)/C)C

STK538523
Synonyms: 6- ({2- [(3- chlorophenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (4- methoxyphenyl)- 2- methyl- N- phenylpyridine- 3- carboxamide
Smiles: COc1ccc(cc1)c1c(C#N)c(SCC(=O)Nc2cccc(c2)Cl)nc(c1C(=O)Nc1ccccc1)C

STK538524
Synonyms: 6- ({2- [(3- chloro- 4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- N- (2- methoxyphenyl)- 2- methyl- 4- (5- methylfuran- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)C)NC(=C(C1c1ccc(o1)C)C(=O)Nc1ccccc1OC)C

STK839626
Synonyms: 2- {[5- (2,3- dihydro- 1,4- benzodioxin- 2- yl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (3- nitrophenyl)ethanone
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])CSc1nnc(n1c1ccccc1)C1COc2c(O1)cccc2

STK839627
Synonyms: methyl4- (2- chlorophenyl)- 6- ({2- [(3- chlorophenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)Cl)NC(=C(C1c1ccccc1Cl)C(=O)OC)C

STK538527
Synonyms: ethyl1- ({(5E)- 5- [4- (dimethylamino)benzylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}methyl)piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CN1C(=S)S/C(=C/c2ccc(cc2)N(C)C)/C1=O

STK538528
Synonyms: methyl5- cyano- 4- (2,4- dichlorophenyl)- 6- (methylsulfanyl)- 2- oxo- 1,2,3,4- tetrahydropyridine- 3- carboxylate
Smiles: COC(=O)C1C(=O)NC(=C(C1c1ccc(cc1Cl)Cl)C#N)SC

STK839632
Synonyms: N- (3- chloro- 2- methylphenyl)- 2- {[3- cyano- 4- (4- fluorophenyl)- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2C)Cl)NC(=O)CC1c1ccc(cc1)F

STK538533
Synonyms: benzyl4- (4- chlorophenyl)- 5- cyano- 6- ({2- [(4- methoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: COc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)OCc1ccccc1)c1ccc(cc1)Cl

STK839634
Synonyms: 2- methoxyethyl4- (2- chlorophenyl)- 5- cyano- 6- ({2- [(2,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: COCCOC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1ccc(cc1C)C

STK538537
Synonyms: 4- (4- chlorophenyl)- 5- cyano- 6- ({2- [(3,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N- phenylpyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(c(c2)C)C)nc(c(c1c1ccc(cc1)Cl)C(=O)Nc1ccccc1)C

STK839636
Synonyms: 4- (4- tert- butylphenoxy)- 1- methyl[1,2,4]triazolo[4,3- a]quinoxaline
Smiles: Cc1nnc2n1c1ccccc1nc2Oc1ccc(cc1)C(C)(C)C

STK839638
Synonyms: 3- amino- N- (4- ethylphenyl)- 4- (furan- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: CCc1ccc(cc1)NC(=O)c1sc2c(c1N)c(c1ccco1)c1c(n2)CCCC1

STK839640
Synonyms: 5- cyano- 4- (4- methoxyphenyl)- 2- methyl- 6- ({2- [(4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- N- phenylpyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2)C)nc(c(c1c1ccc(cc1)OC)C(=O)Nc1ccccc1)C

STK839643
Synonyms: 2- {[3- cyano- 5- oxo- 4- (thiophen- 2- yl)- 1,4,5,6,7,8- hexahydroquinolin- 2- yl]sulfanyl}- N- (2,6- dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2c(C)cccc2C)NC2=C(C1c1cccs1)C(=O)CCC2

STK839644
Synonyms: methyl3- amino- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxylate
Smiles: COC(=O)c1sc2c(c1N)c(c1cccs1)c1c(n2)CCCC1

STK839646
Synonyms: prop- 2- en- 1- yl5- cyano- 6- ({2- [(2,6- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1c(C)cccc1C

STK839647
Synonyms: 5- cyano- 6- ({2- [(4- ethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (furan- 2- yl)- 2- methyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)CC)NC(=C(C1c1ccco1)C(=O)N)C

STK538544
Synonyms: N- {[4- (heptyloxy)phenyl]carbonyl}alanine
Smiles: CCCCCCCOc1ccc(cc1)C(=O)NC(C(=O)O)C

STK839649
Synonyms: 6- (butylsulfanyl)- 4- (2- methoxyphenyl)- 2- oxo- 1,2,3,4- tetrahydropyridine- 3,5- dicarbonitrile
Smiles: CCCCSC1=C(C#N)C(C(C(=O)N1)C#N)c1ccccc1OC

STK839651
Synonyms: 4- (2,3- dichlorophenyl)- 2- (ethylsulfanyl)- 6- oxo- 1,4,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: CCSC1=C(C#N)C(CC(=O)N1)c1cccc(c1Cl)Cl

STK839652
Synonyms: 2- ({3- cyano- 6- oxo- 4- [4- (propan- 2- yl)phenyl]- 1,4,5,6- tetrahydropyridin- 2- yl}sulfanyl)- N- (4- phenoxyphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)Oc2ccccc2)NC(=O)CC1c1ccc(cc1)C(C)C

STK538548
Synonyms: 4- (4- chlorophenyl)- 5- cyano- 6- ({2- [(4- ethoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N- phenylpyridine- 3- carboxamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nc(C)c(c(c1C#N)c1ccc(cc1)Cl)C(=O)Nc1ccccc1

STK839657
Synonyms: 3- amino- N- (4- ethoxyphenyl)- 4- (furan- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: CCOc1ccc(cc1)NC(=O)c1sc2c(c1N)c(c1ccco1)c1c(n2)CCCC1

STK538554
Synonyms: 2- oxo- 4- phenyl- N'- [(E)- {5- [3- (trifluoromethyl)phenyl]furan- 2- yl}methylidene]pyrrolidine- 3- carbohydrazide
Smiles: O=C(C1C(=O)NCC1c1ccccc1)N/N=C/c1ccc(o1)c1cccc(c1)C(F)(F)F

STK839658
Synonyms: prop- 2- en- 1- yl5- cyano- 4- (furan- 2- yl)- 2- methyl- 6- {[2- oxo- 2- (1,3- thiazol- 2- ylamino)ethyl]sulfanyl}- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1nccs1

STK538555
Synonyms: 5- [(1,3- benzodioxol- 5- ylmethyl)sulfamoyl]- 2- methoxybenzoicacid
Smiles: COc1ccc(cc1C(=O)O)S(=O)(=O)NCc1ccc2c(c1)OCO2

STK538556
Synonyms: 2- amino- 6- (methylsulfanyl)- 4- (thiophen- 2- yl)pyridine- 3,5- dicarbonitrile
Smiles: N#Cc1c(SC)nc(c(c1c1cccs1)C#N)N

STK839661
Synonyms: 5- {[(3- fluorophenyl)amino]methylidene}- 2,2- dimethyl- 1,3- dioxane- 4,6- dione
Smiles: Fc1cccc(c1)NC=C1C(=O)OC(OC1=O)(C)C

STK839662
Synonyms: 3- (5- bromofuran- 2- yl)- 5,5- dimethyl- 5,6- dihydro[1,2,4]triazolo[3,4- a]isoquinoline
Smiles: Brc1ccc(o1)c1nnc2n1C(C)(C)Cc1c2cccc1

STK839663
Synonyms: 2- ({4- [4- (benzyloxy)- 3- methoxyphenyl]- 3- cyano- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl}sulfanyl)- N- phenylacetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2)NC(=O)CC1c1ccc(c(c1)OC)OCc1ccccc1

STK839666
Synonyms: 2- {[3- cyano- 4- (4- methylphenyl)- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}- N- (4- fluorophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)F)NC(=O)CC1c1ccc(cc1)C

STK839667
Synonyms: 4- phenyl- 5- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1c1ccccc1)C12CC3CC(C2)CC(C1)C3

STK538568
Synonyms: methyl6- (benzylsulfanyl)- 5- cyano- 4- (4- methylphenyl)- 2- oxo- 1,2,3,4- tetrahydropyridine- 3- carboxylate
Smiles: COC(=O)C1C(=O)NC(=C(C1c1ccc(cc1)C)C#N)SCc1ccccc1

STK538569
Synonyms: 3- (3- phenylpyridazino[3,4- b]quinoxalin- 5(10H)- yl)propan- 1- ol
Smiles: OCCCn1c2cc(nnc2[nH]c2c1cccc2)c1ccccc1

STK538572
Synonyms: ethyl5- fluoro- 3- {(E)- [4- (4- fluorophenyl)piperazin- 1- yl]diazenyl}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCN(CC1)c1ccc(cc1)F)cc(cc2)F

STK839671
Synonyms: prop- 2- en- 1- yl5- cyano- 6- ({2- [(2,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1ccc(cc1C)C

STK538576
Synonyms: 6- ({2- [(3- bromophenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (furan- 2- yl)- N- (2- methoxyphenyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)Br)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1OC)C

STK839672
Synonyms: 5- cyano- N- (2- methoxyphenyl)- 2- methyl- 4- (5- methylfuran- 2- yl)- 6- {[2- oxo- 2- (1,3- thiazol- 2- ylamino)ethyl]sulfanyl}- 1,4- dihydropyridine- 3- carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2nccs2)NC(=C(C1c1ccc(o1)C)C(=O)Nc1ccccc1OC)C

STK538578
Synonyms: 2- {[5- (3- chloro- 6- methoxy- 1- benzothiophen- 2- yl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (4- fluorophenyl)ethanone
Smiles: COc1ccc2c(c1)sc(c2Cl)c1nnc(n1c1ccccc1)SCC(=O)c1ccc(cc1)F

STK538579
Synonyms: ethyl6- [(4- chlorobenzyl)sulfanyl]- 5- cyano- 4- (2- fluorophenyl)- 2- oxo- 1,2,3,4- tetrahydropyridine- 3- carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=C(C1c1ccccc1F)C#N)SCc1ccc(cc1)Cl

STK538580
Synonyms: 5- cyano- 4- (3,4- dimethoxyphenyl)- 2- methyl- 6- {[2- oxo- 2- (phenylamino)ethyl]sulfanyl}- N- phenylpyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2ccccc2)nc(c(c1c1ccc(c(c1)OC)OC)C(=O)Nc1ccccc1)C

STK538582
Synonyms: benzyl6- {[2- (benzyloxy)- 2- oxoethyl]sulfanyl}- 4- (4- chlorophenyl)- 5- cyano- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: N#CC1=C(SCC(=O)OCc2ccccc2)NC(=C(C1c1ccc(cc1)Cl)C(=O)OCc1ccccc1)C

STK839675
Synonyms: 2,2- dimethyl- 5- {[(2,4,6- trimethylphenyl)amino]methylidene}- 1,3- dioxane- 4,6- dione
Smiles: Cc1cc(C)c(c(c1)C)NC=C1C(=O)OC(OC1=O)(C)C

STK839676
Synonyms: (5E)- 2- (4- acetylpiperazin- 1- yl)- 5- [4- (benzyloxy)benzylidene]- 1,3- thiazol- 4(5H)- one
Smiles: CC(=O)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(cc2)OCc2ccccc2)/S1

STK839677
Synonyms: benzyl4- (4- chlorophenyl)- 5- cyano- 2- methyl- 6- [(2- oxo- 2- phenylethyl)sulfanyl]- 1,4- dihydropyridine- 3- carboxylate
Smiles: N#CC1=C(SCC(=O)c2ccccc2)NC(=C(C1c1ccc(cc1)Cl)C(=O)OCc1ccccc1)C

STK839678
Synonyms: 3- amino- 4- (furan- 2- yl)- N- (3- methylphenyl)- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: Cc1cccc(c1)NC(=O)c1sc2c(c1N)c(c1ccco1)c1c(n2)CCCC1

STK538583
Synonyms: 2- {[3- cyano- 4- (furan- 2- yl)- 5,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- (4- phenoxyphenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2)Oc2ccccc2)nc2c(c1c1ccco1)CCCC2

STK839679
Synonyms: 3- {[(2- fluoro- 5- nitrophenyl)amino]methylidene}- 1,5- dioxaspiro[5.5]undecane- 2,4- dione
Smiles: O=C1OC2(CCCCC2)OC(=O)C1=CNc1cc(ccc1F)[N+](=O)[O-]

STK538586
Synonyms: methyl6- [(4- chlorobenzyl)sulfanyl]- 5- cyano- 4- (4- ethoxyphenyl)- 2- oxo- 1,2,3,4- tetrahydropyridine- 3- carboxylate
Smiles: CCOc1ccc(cc1)C1C(C(=O)OC)C(=O)NC(=C1C#N)SCc1ccc(cc1)Cl

STK839682
Synonyms: 2- methoxyethyl4- (2- chlorophenyl)- 5- cyano- 2- methyl- 6- ({2- [(4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: COCCOC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1ccc(cc1)C

STK538587
Synonyms: [4- (trifluoromethyl)phenyl][(3bS,4aR)- 3,4,4- trimethyl- 3b,4,4a,5- tetrahydro- 1H- cyclopropa[3,4]cyclopenta[1,2- c]pyrazol- 1- yl]methanone
Smiles: Cc1nn(c2c1[C@H]1[C@@H](C2)C1(C)C)C(=O)c1ccc(cc1)C(F)(F)F

STK538588
Synonyms: 3- butyl- 4,8- dichloro- 2- methylquinoline
Smiles: CCCCc1c(C)nc2c(c1Cl)cccc2Cl

STK839683
Synonyms: ethyl(2Z)- (hydroxyimino)(4'H- spiro[cyclopentane- 1,3'- isoquinolin]- 1'- yl)ethanoate
Smiles: CCOC(=O)/C(=N\O)/C1=NC2(CCCC2)Cc2c1cccc2

STK538592
Synonyms: 4- [4- (5- chloro- 2- methylphenyl)piperazin- 1- yl]- 8- fluoro- 5H- pyrimido[5,4- b]indole
Smiles: Fc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)c1cc(Cl)ccc1C

STK538594
Synonyms: 2- {[4- (4- chlorophenyl)- 3- cyano- 5- oxo- 1,4,5,6,7,8- hexahydroquinolin- 2- yl]sulfanyl}- N- (3,4- dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)C)C)NC2=C(C1c1ccc(cc1)Cl)C(=O)CCC2

STK538595
Synonyms: butyl{[3- cyano- 4- (2,3- dichlorophenyl)- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}acetate
Smiles: CCCCOC(=O)CSC1=C(C(CC(=O)N1)c1cccc(c1Cl)Cl)C#N

STK839685
Synonyms: N~2~- benzyl- N~4~- butyl- 6- methylpyrimidine- 2,4- diamine
Smiles: CCCCNc1cc(C)nc(n1)NCc1ccccc1

STK839686
Synonyms: ethyl2- ({[4- (1,3- dioxo- 1H- benzo[de]isoquinolin- 2(3H)- yl)butanoyl]carbamothioyl}amino)- 4,5- dimethylthiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)CCCn2c(=O)c3cccc4c3c(c2=O)ccc4)sc(c1C)C

STK538596
Synonyms: methyl4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- 5- {[(diphenylmethyl)carbamoyl]amino}- 5- oxopentanoate
Smiles: COC(=O)CCC(N1C(=O)c2c(C1=O)cccc2)C(=O)NC(=O)NC(c1ccccc1)c1ccccc1

STK538597
Synonyms: 2- ({4- [4- (benzyloxy)- 3- methoxyphenyl]- 3- cyano- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl}sulfanyl)- N- (2,4,6- trimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2c(C)cc(cc2C)C)NC(=O)CC1c1ccc(c(c1)OC)OCc1ccccc1

STK839688
Synonyms: prop- 2- en- 1- yl5- cyano- 6- ({2- [(2- ethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (furan- 2- yl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1ccccc1CC

STK839689
Synonyms: butyl{[3- cyano- 4- (2- fluorophenyl)- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}acetate
Smiles: CCCCOC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccccc1F

STK839690
Synonyms: N~2~- benzyl- N~4~- (4- chlorophenyl)- 6- methylpyrimidine- 2,4- diamine
Smiles: Clc1ccc(cc1)Nc1cc(C)nc(n1)NCc1ccccc1

STK538603
Synonyms: [2- (diphenylphosphoryl)ethyl](2- phenylethyl)phosphinicacid
Smiles: OP(=O)(CCP(=O)(c1ccccc1)c1ccccc1)CCc1ccccc1

STK839692
Synonyms: [3- amino- 4- (furan- 2- yl)- 6- phenylthieno[2,3- b]pyridin- 2- yl](4- fluorophenyl)methanone
Smiles: Fc1ccc(cc1)C(=O)c1sc2c(c1N)c(cc(n2)c1ccccc1)c1ccco1

STK839693
Synonyms: ethyl(2E)- (hydroxyimino)(3,3,6,7- tetramethyl- 3,4- dihydroisoquinolin- 1- yl)ethanoate
Smiles: CCOC(=O)/C(=N/O)/C1=NC(C)(C)Cc2c1cc(C)c(c2)C

STK839696
Synonyms: propyl{[3- cyano- 4- (2- fluorophenyl)- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}acetate
Smiles: CCCOC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccccc1F

STK839697
Synonyms: 3- {[(3- methoxyphenyl)amino]methylidene}- 1,5- dioxaspiro[5.5]undecane- 2,4- dione
Smiles: COc1cccc(c1)NC=C1C(=O)OC2(OC1=O)CCCCC2

STK839698
Synonyms: methyl4- (2- chlorophenyl)- 5- cyano- 6- ({2- [(2,4- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: COC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1ccc(cc1C)C

STK839700
Synonyms: 2- {[3- cyano- 4- (furan- 2- yl)- 5,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1c1ccco1)CCCC2

STK839702
Synonyms: 6- ({2- [(4- butoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (furan- 2- yl)- 2- methyl- 1,4- dihydropyridine- 3- carboxamide
Smiles: CCCCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)N)c1ccco1

STK839703
Synonyms: (2Z)- 2- (3,3- dimethyl- 3,4- dihydroisoquinolin- 1(2H)- ylidene)hydrazinecarboxamide
Smiles: NC(=O)N/N=C/1\NC(C)(C)Cc2c1cccc2

STK839704
Synonyms: ethyl5- cyano- 4- (2- methylphenyl)- 2- oxo- 6- (prop- 2- en- 1- ylsulfanyl)- 1,2,3,4- tetrahydropyridine- 3- carboxylate
Smiles: C=CCSC1=C(C#N)C(C(C(=O)N1)C(=O)OCC)c1ccccc1C

STK538616
Synonyms: N'- [(1E)- 1- (3,4- dimethoxyphenyl)ethylidene]- 1- methyl- 1H- indole- 3- carbohydrazide
Smiles: COc1cc(ccc1OC)/C(=N/NC(=O)c1cn(c2c1cccc2)C)/C

STK839708
Synonyms: N- (3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)- 4- (1,3- dioxo- 1H- benzo[de]isoquinolin- 2(3H)- yl)butanamide
Smiles: N#Cc1c(NC(=O)CCCn2c(=O)c3cccc4c3c(c2=O)ccc4)sc2c1CCCC2

STK538618
Synonyms: 2,2'- [(2- butoxy- 5- methylbenzyl)imino]diethanol
Smiles: CCCCOc1ccc(cc1CN(CCO)CCO)C

STK839710
Synonyms: (5Z)- 5- (1,3- benzodioxol- 5- ylmethylidene)- 3- [3- (4- methylpiperazin- 1- yl)- 3- oxopropyl]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CN1CCN(CC1)C(=O)CCN1C(=S)S/C(=C\c2ccc3c(c2)OCO3)/C1=O

STK538620
Synonyms: 6- ({2- [(3- chlorophenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 4- (4- ethoxyphenyl)- 2- methyl- N- phenylpyridine- 3- carboxamide
Smiles: CCOc1ccc(cc1)c1c(C#N)c(SCC(=O)Nc2cccc(c2)Cl)nc(c1C(=O)Nc1ccccc1)C

STK538621
Synonyms: 2- ({4- [4- (benzyloxy)phenyl]- 3- cyano- 5- oxo- 1,4,5,6,7,8- hexahydroquinolin- 2- yl}sulfanyl)- N- (2,3- dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2C)C)NC2=C(C1c1ccc(cc1)OCc1ccccc1)C(=O)CCC2

STK538622
Synonyms: 4- (4- chlorophenyl)- 5- cyano- 6- ({2- [(4- ethoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N- (2- methylphenyl)pyridine- 3- carboxamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nc(C)c(c(c1C#N)c1ccc(cc1)Cl)C(=O)Nc1ccccc1C

STK538625
Synonyms: ethyl4- (2- chlorophenyl)- 6- ({2- [(4- chlorophenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 2- propyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: CCOC(=O)C1=C(CCC)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1ccc(cc1)Cl

STK839713
Synonyms: 2- (4- oxo- 4- {4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}butyl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: O=C(N1CCN(CC1)C/C=C/c1ccccc1)CCCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK839714
Synonyms: 2- {[3- cyano- 4- (4- fluorophenyl)- 6- oxo- 1,4,5,6- tetrahydropyridin- 2- yl]sulfanyl}- N- (2,4- dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2C)C)NC(=O)CC1c1ccc(cc1)F

STK538628
Synonyms: 4- (4- chlorophenyl)- 5- cyano- 6- ({2- [(4- ethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N- phenylpyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2)CC)nc(c(c1c1ccc(cc1)Cl)C(=O)Nc1ccccc1)C

STK839715
Synonyms: 4- (2- ethoxyphenyl)- 2- (methylsulfanyl)- 5- oxo- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: CCOc1ccccc1C1C(=C(SC)NC2=C1C(=O)CCC2)C#N

STK839717
Synonyms: prop- 2- en- 1- yl5- cyano- 2- methyl- 6- ({2- [(4- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1ccc(cc1)C

STK538634
Synonyms: N- (3- acetylphenyl)- 2- ({4- [4- (benzyloxy)phenyl]- 3- cyano- 5- oxo- 1,4,5,6,7,8- hexahydroquinolin- 2- yl}sulfanyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)C(=O)C)NC2=C(C1c1ccc(cc1)OCc1ccccc1)C(=O)CCC2

STK839721
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 6- oxo- 2- (propylsulfanyl)- 1,4,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: CCCSC1=C(C#N)C(CC(=O)N1)c1ccc2c(c1)OCO2

STK538635
Synonyms: (5- methyl- 3- phenyl- 1,2- oxazol- 4- yl)[(3bS,4aR)- 3,4,4- trimethyl- 3b,4,4a,5- tetrahydro- 1H- cyclopropa[3,4]cyclopenta[1,2- c]pyrazol- 1- yl]methanone
Smiles: Cc1onc(c1C(=O)n1nc(c2c1C[C@@H]1[C@H]2C1(C)C)C)c1ccccc1

STK538636
Synonyms: 2- {[4- (4- chlorophenyl)- 3- cyano- 5- oxo- 1,4,5,6,7,8- hexahydroquinolin- 2- yl]sulfanyl}- N- (4- methylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C)NC2=C(C1c1ccc(cc1)Cl)C(=O)CCC2

STK839722
Synonyms: N~2~- benzyl- N~4~- (4- methoxyphenyl)- 6- methylpyrimidine- 2,4- diamine
Smiles: COc1ccc(cc1)Nc1cc(C)nc(n1)NCc1ccccc1

STK538637
Synonyms: 1- methyl- 4- (piperidin- 1- yl)[1,2,4]triazolo[4,3- a]quinoxaline
Smiles: Cc1nnc2n1c1ccccc1nc2N1CCCCC1

STK839724
Synonyms: prop- 2- en- 1- yl6- ({2- [(4- acetylphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 2- methyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1ccc(cc1)C(=O)C

STK538639
Synonyms: 2- methoxyethyl6- ({2- [(3- chloro- 2- methylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (2- chlorophenyl)- 5- cyano- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: COCCOC(=O)C1=C(C)NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1cccc(c1C)Cl

STK839725
Synonyms: 3- {[(3,4- difluorophenyl)amino]methylidene}- 1,5- dioxaspiro[5.5]undecane- 2,4- dione
Smiles: O=C1OC2(CCCCC2)OC(=O)C1=CNc1ccc(c(c1)F)F

STK538641
Synonyms: 3- butyl- 2,8- dimethylquinoline- 4- thiol
Smiles: CCCCc1c(C)nc2c(c1S)cccc2C

STK538642
Synonyms: 2- (diethylamino)- 1- (5- methoxy- 1H- indol- 3- yl)ethanone
Smiles: CCN(CC(=O)c1c[nH]c2c1cc(OC)cc2)CC

STK839726
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 2- (methylsulfanyl)- 6- oxo- 1,4,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: N#CC1=C(SC)NC(=O)CC1c1ccc2c(c1)OCO2

STK538644
Synonyms: 4- (4- chlorophenyl)- 5- cyano- 6- ({2- [(4- ethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 2- methyl- N- (2- methylphenyl)pyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2)CC)nc(c(c1c1ccc(cc1)Cl)C(=O)Nc1ccccc1C)C

STK839727
Synonyms: 3- amino- 2- [(4- chlorophenyl)carbonyl]- 7,8- dihydrothieno[2,3- b]quinolin- 5(6H)- one
Smiles: Clc1ccc(cc1)C(=O)c1sc2c(c1N)cc1c(n2)CCCC1=O

STK839728
Synonyms: 4- {[(2,4- dioxo- 1,5- dioxaspiro[5.5]undec- 3- ylidene)methyl]amino}benzenesulfonamide
Smiles: O=C1OC2(CCCCC2)OC(=O)C1=CNc1ccc(cc1)S(=O)(=O)N

STK839729
Synonyms: 3- amino- 2- [(4- fluorophenyl)carbonyl]- 7,7- dimethyl- 7,8- dihydrothieno[2,3- b]quinolin- 5(6H)- one
Smiles: Fc1ccc(cc1)C(=O)c1sc2c(c1N)cc1c(n2)CC(CC1=O)(C)C

STK538645
Synonyms: methyl5- cyano- 6- (methylsulfanyl)- 2- oxo- 4- phenyl- 1,2,3,4- tetrahydropyridine- 3- carboxylate
Smiles: COC(=O)C1C(=O)NC(=C(C1c1ccccc1)C#N)SC

STK839730
Synonyms: prop- 2- en- 1- yl5- cyano- 6- ({2- [(2,5- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (furan- 2- yl)- 2- methyl- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1cc(C)ccc1C

STK839731
Synonyms: 2- [2- oxo- 2- (4- phenylpiperazin- 1- yl)ethyl]- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: O=C(N1CCN(CC1)c1ccccc1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3

STK538647
Synonyms: ethyl(2E)- 3- {4- [bis(2- hydroxyethyl)amino]- 2- chloro- 6- methylpyrimidin- 5- yl}prop- 2- enoate
Smiles: OCCN(c1nc(Cl)nc(c1/C=C/C(=O)OCC)C)CCO

STK538648
Synonyms: prop- 2- en- 1- yl6- ({2- [(4- chloro- 2,5- dimethoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- 5- cyano- 2- methyl- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1cc(OC)c(cc1OC)Cl

STK538653
Synonyms: ethyl3- ({2- [4- (5- chloro- 2- methylphenyl)piperazin- 1- yl]propanoyl}amino)- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(CC1)c1cc(Cl)ccc1C)C)cc(cc2)F

STK538655
Synonyms: 4- (4- methylpiperazin- 1- yl)- 2- (3- nitrophenyl)quinazoline
Smiles: CN1CCN(CC1)c1nc(nc2c1cccc2)c1cccc(c1)[N+](=O)[O-]

STK839733
Synonyms: prop- 2- en- 1- yl5- cyano- 2- methyl- 6- {[2- oxo- 2- (1,3- thiazol- 2- ylamino)ethyl]sulfanyl}- 4- (thiophen- 2- yl)- 1,4- dihydropyridine- 3- carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)Nc1nccs1

STK538657
Synonyms: 4- (4- chlorophenyl)- 5- cyano- 2- methyl- N- (2- methylphenyl)- 6- ({2- [(2- methylphenyl)amino]- 2- oxoethyl}sulfanyl)pyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2ccccc2C)nc(c(c1c1ccc(cc1)Cl)C(=O)Nc1ccccc1C)C

STK538658
Synonyms: 3- amino- 7,7- dimethyl- N- (naphthalen- 2- yl)- 5- oxo- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)cc1c(n2)CC(CC1=O)(C)C)Nc1ccc2c(c1)cccc2

STK839734
Synonyms: 3- {[(2,4- difluorophenyl)amino]methylidene}- 1,5- dioxaspiro[5.5]undecane- 2,4- dione
Smiles: Fc1ccc(c(c1)F)NC=C1C(=O)OC2(OC1=O)CCCCC2

STK538659
Synonyms: methyl5- cyano- 4- (4- methylphenyl)- 6- {[2- (naphthalen- 2- ylamino)- 2- oxoethyl]sulfanyl}- 2- oxo- 1,2,3,4- tetrahydropyridine- 3- carboxylate
Smiles: COC(=O)C1C(=O)NC(=C(C1c1ccc(cc1)C)C#N)SCC(=O)Nc1ccc2c(c1)cccc2

STK538660
Synonyms: 5- cyano- 6- ({2- [(4- ethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (4- methoxyphenyl)- 2- methyl- N- phenylpyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2)CC)nc(c(c1c1ccc(cc1)OC)C(=O)Nc1ccccc1)C

STK538663
Synonyms: 2- ({4- [4- (benzyloxy)phenyl]- 3- cyano- 5- oxo- 1,4,5,6,7,8- hexahydroquinolin- 2- yl}sulfanyl)- N- (2,6- dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2c(C)cccc2C)NC2=C(C1c1ccc(cc1)OCc1ccccc1)C(=O)CCC2

STK538665
Synonyms: 5- cyano- 6- ({2- [(4- ethoxyphenyl)amino]- 2- oxoethyl}sulfanyl)- N- (2- methoxyphenyl)- 2- methyl- 4- (5- methylfuran- 2- yl)- 1,4- dihydropyridine- 3- carboxamide
Smiles: CCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1OC)c1ccc(o1)C

STK538666
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 2- [(3- cyanopropyl)sulfanyl]- 6- oxo- 1,4,5,6- tetrahydropyridine- 3- carbonitrile
Smiles: N#CCCCSC1=C(C#N)C(CC(=O)N1)c1ccc2c(c1)OCO2

STK839738
Synonyms: ethyl4- [4- (1,3- dioxo- 1H- benzo[de]isoquinolin- 2(3H)- yl)butanoyl]piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)CCCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK538668
Synonyms: 6- ({2- [(4- bromophenyl)amino]- 2- oxoethyl}sulfanyl)- 4- (4- chlorophenyl)- 5- cyano- 2- methyl- N- (2- methylphenyl)pyridine- 3- carboxamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2)Br)nc(c(c1c1ccc(cc1)Cl)C(=O)Nc1ccccc1C)C

STK538669
Synonyms: 6- [9- bromo- 2- (furan- 2- yl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1c(OC)ccc(c1C(=O)O)C1Oc2ccc(cc2C2N1N=C(C2)c1ccco1)Br

STK538671
Synonyms: N'- [(E)- (1- ethyl- 3,5- dimethyl- 1H- pyrazol- 4- yl)methylidene]- 2- methylquinoline- 4- carbohydrazide
Smiles: CCn1nc(c(c1C)/C=N/NC(=O)c1cc(C)nc2c1cccc2)C

STK538674
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (3- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cccc(c1)/C=N/NC(=O)Cn1nnc(n1)N

STK538682
Synonyms: 1- amino- N- (4- chlorophenyl)- 8,8- dimethyl- 5- (morpholin- 4- yl)- 8,9- dihydro- 6H- pyrano[4,3- d]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCOCC1

STK538685
Synonyms: N- (4- {3- hydroxy- 4- [(4- methylphenyl)carbonyl]- 2- oxo- 5- phenyl- 2,5- dihydro- 1H- pyrrol- 1- yl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1)C(=O)c1ccc(cc1)C)O

STK538686
Synonyms: 4- [3- acetyl- 2- (4- bromophenyl)- 4- hydroxy- 5- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl]butanoicacid
Smiles: OC(=O)CCCN1C(c2ccc(cc2)Br)C(=C(C1=O)O)C(=O)C

STK538692
Synonyms: 4- (4- methoxyphenyl)- 1- (methylsulfanyl)- 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: CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)OC)CC(OC3)C(C)C

STK538702
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (3- hydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1cccc(c1)O

STK538708
Synonyms: 2- (1,3- benzothiazol- 2- ylsulfanyl)- N'- [(E)- (1,3- dimethyl- 1H- pyrazol- 4- yl)methylidene]acetohydrazide
Smiles: O=C(CSc1nc2c(s1)cccc2)N/N=C/c1cn(nc1C)C

STK839745
Synonyms: ethyl6- bromo- 5- [(3- fluorobenzyl)oxy]- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1cccc(c1)F)c(c2)Br)c1ccccc1

STK538712
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (4- bromophenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1ccc(cc1)Br

STK538714
Synonyms: N'- [(E)- (3- 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/c1cccc(c1)Cl

STK538718
Synonyms: 8- [(2E)- 2- (4- fluorobenzylidene)hydrazinyl]- 7- [2- hydroxy- 3- (propan- 2- yloxy)propyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(N/N=C/c2ccc(cc2)F)nc2c1c(=O)[nH]c(=O)n2C)COC(C)C

STK538719
Synonyms: 4- [(5E)- 4- oxo- 5- (pyridin- 3- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoicacid
Smiles: OC(=O)CCCN1C(=S)S/C(=C/c2cccnc2)/C1=O

STK839746
Synonyms: 4- (4- bromophenyl)- 3- methyl- 1- phenyl- 4,8- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7(6H)- one
Smiles: O=C1CSC(c2c(N1)n(nc2C)c1ccccc1)c1ccc(cc1)Br

STK538720
Synonyms: (2E)- 2- (4- hydroxy- 3- methoxybenzylidene)- N- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)hydrazinecarboxamide
Smiles: COc1cc(/C=N/NC(=O)NC23CC4CC(C3)CC(C2)C4)ccc1O

STK538723
Synonyms: 5- (2- methylpropyl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8(9H)- one
Smiles: CC(Cc1nc2sc3c(c2c2c1CCCC2)nc[nH]c3=O)C

STK538728
Synonyms: ethyl2- hydroxy- 4- methyl- 5- phenyl- 2,5- dihydro- 1,2- oxaphosphole- 5- carboxylate2- oxide
Smiles: CCOC(=O)C1(OP(=O)(C=C1C)O)c1ccccc1

STK538738
Synonyms: 3,6- diamino- 5- cyano- N- (4- methoxybenzyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1sc2c(c1N)cc(c(n2)N)C#N

STK538739
Synonyms: 5- (3,4- dimethoxyphenyl)- 2- {[(4- methoxyphenyl)amino]methylidene}cyclohexane- 1,3- dione
Smiles: COc1ccc(cc1)N/C=C/1\C(=O)CC(CC1=O)c1ccc(c(c1)OC)OC

STK538741
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (1- ethyl- 3,5- dimethyl- 1H- pyrazol- 4- yl)methylidene]acetohydrazide
Smiles: CCn1nc(c(c1C)/C=N/NC(=O)Cn1nnc(n1)N)C

STK538742
Synonyms: N'- [(1Z)- 1- (4- bromophenyl)ethylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: C/C(=N/NC(=O)Cn1ncnc1)/c1ccc(cc1)Br

STK839760
Synonyms: ethyl2- tert- butyl- 5- [(3- methylbut- 2- en- 1- yl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCC=C(C)C)ccc2oc1C(C)(C)C

STK839761
Synonyms: 9- (4- ethylphenyl)- 7- hydroxy- 1- methyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: CCc1ccc(cc1)N1CC(O)Cn2c1nc1c2c(=O)[nH]c(=O)n1C

STK538746
Synonyms: 1- methyl- 4- nitro- N- (pyridin- 2- ylmethyl)- 1H- imidazol- 5- amine
Smiles: Cn1cnc(c1NCc1ccccn1)[N+](=O)[O-]

STK538751
Synonyms: ethyl2- tert- butyl- 5- [2- (4- chlorophenyl)- 2- oxoethoxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCC(=O)c3ccc(cc3)Cl)ccc2oc1C(C)(C)C

STK839765
Synonyms: 3- bromo- N- [4- (5- methyl- 1,3- benzothiazol- 2- yl)phenyl]benzamide
Smiles: Brc1cccc(c1)C(=O)Nc1ccc(cc1)c1sc2c(n1)cc(cc2)C

STK538763
Synonyms: 3- (4- {[5- (2,4- dichlorophenyl)furan- 2- yl]carbonothioyl}piperazin- 1- yl)propanenitrile
Smiles: N#CCCN1CCN(CC1)C(=S)c1ccc(o1)c1ccc(cc1Cl)Cl

STK538766
Synonyms: {[3- cyano- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}(phenyl)aceticacid
Smiles: N#Cc1c(SC(c2ccccc2)C(=O)O)nc2c(c1c1cccs1)CCCC2

STK839776
Synonyms: 3- methoxy- N- [(1- phenylcyclopentyl)methyl]- 4- propoxybenzamide
Smiles: CCCOc1ccc(cc1OC)C(=O)NCC1(CCCC1)c1ccccc1

STK839777
Synonyms: 2- methoxyethyl6- bromo- 5- [(3- chlorobenzyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCc1cccc(c1)Cl)c(c2)Br

STK538773
Synonyms: N- [4- (1,3- dioxo- 2,3- dihydro- 1H- inden- 2- yl)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)C1C(=O)c2c(C1=O)cccc2

STK839778
Synonyms: propan- 2- yl5- [(2- chloro- 4- fluorobenzyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CC(OC(=O)c1c(C)oc2c1cc(OCc1ccc(cc1Cl)F)cc2)C

STK538775
Synonyms: N- (2- bromo- 4- methylphenyl)- 2,2- difluoro- 2- (2,3,3,4,4,5,5- heptafluorotetrahydrofuran- 2- yl)acetamide
Smiles: Cc1ccc(c(c1)Br)NC(=O)C(C1(F)OC(C(C1(F)F)(F)F)(F)F)(F)F

STK839782
Synonyms: ethyl6- bromo- 2- tert- butyl- 5- [(2- chloro- 6- fluorobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCc3c(F)cccc3Cl)c(cc2oc1C(C)(C)C)Br

STK538791
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(2Z,3E)- 4- phenylbut- 3- en- 2- ylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C(\C=C\c1ccccc1)/C

STK538792
Synonyms: ethyl5- [(2,2- dimethylpropanoyl)oxy]- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(cc2)OC(=O)C(C)(C)C)c1ccc(cc1)OC

STK839784
Synonyms: ethyl5- [(4- fluorobenzyl)oxy]- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1ccc(cc1)F)cc2)c1ccc(cc1)OC

STK538795
Synonyms: 2- [(1- {[4- (azepan- 1- ylsulfonyl)phenyl]carbonyl}piperidin- 4- yl)methyl]- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: O=C(c1ccc(cc1)S(=O)(=O)N1CCCCCC1)N1CCC(CC1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3

STK839787
Synonyms: morpholin- 4- yl[1- (naphthalen- 1- ylmethyl)- 1H- indol- 3- yl]methanethione
Smiles: S=C(c1cn(c2c1cccc2)Cc1cccc2c1cccc2)N1CCOCC1

STK839788
Synonyms: ethyl5- [(2,5- dimethylbenzyl)oxy]- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1cc(C)ccc1C)cc2)c1ccc(cc1)OC

STK538798
Synonyms: 1- cyclopropyl- 6- fluoro- 7- [4- (furan- 2- ylcarbonyl)piperazin- 1- yl]- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: Fc1cc2c(cc1N1CCN(CC1)C(=O)c1ccco1)n(cc(c2=O)C(=O)O)C1CC1

STK839789
Synonyms: N- (3- chlorophenyl)- 6- hydroxy- 4- oxo- 1,2- dihydro- 4H- pyrrolo[3,2,1- ij]quinoline- 5- carboxamide
Smiles: Clc1cccc(c1)NC(=O)c1c(O)c2cccc3c2n(c1=O)CC3

STK538803
Synonyms: (2Z)- 3- (dimethylamino)- 2- (2- oxopyrrolidin- 1- yl)prop- 2- enenitrile
Smiles: N#C/C(=C/N(C)C)/N1CCCC1=O

STK538805
Synonyms: 3- [3- hydroxy- 5- (4- methylphenyl)- 2- oxo- 4- (phenylcarbonyl)- 2,5- dihydro- 1H- pyrrol- 1- yl]propanoicacid
Smiles: OC(=O)CCN1C(c2ccc(cc2)C)C(=C(C1=O)O)C(=O)c1ccccc1

STK538806
Synonyms: 2- [4- (1,3- benzodioxol- 5- ylmethyl)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)Cc1ccc2c(c1)OCO2

STK538809
Synonyms: N'- [(E)- (2- fluorophenyl)methylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1cncn1)N/N=C/c1ccccc1F

STK538810
Synonyms: 4,6- dimethyl- 5- (piperidin- 1- ylcarbonyl)- 2H- pyran- 2- one
Smiles: O=c1cc(C)c(c(o1)C)C(=O)N1CCCCC1

STK538818
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (2- hydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1ccccc1O

STK538822
Synonyms: (5Z)- 5- [(1- methyl- 1H- indol- 3- yl)methylidene]- 1- (3,4,5- trimethoxyphenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1c(OC)cc(cc1OC)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)C)/C1=O

STK538823
Synonyms: 2- ({[(4- chlorophenyl)carbonyl]carbamothioyl}amino)- 6- ethyl- 4,5,6,7- tetrahydrothieno[2,3- c]pyridine- 3- carboxamide
Smiles: CCN1CCc2c(C1)sc(c2C(=O)N)NC(=S)NC(=O)c1ccc(cc1)Cl

STK538826
Synonyms: methyl5- bromo- 3- ({[3- (trifluoromethyl)phenyl]carbonyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1cccc(c1)C(F)(F)F)cc(cc2)Br

STK538828
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(E)- (2- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)Cn1nnnc1N

STK839805
Synonyms: 3- bromo- 9- [2- (ethenyloxy)ethyl]- 9H- carbazole
Smiles: C=COCCn1c2ccc(cc2c2c1cccc2)Br

STK538834
Synonyms: ethyl5- {[(4- fluorophenyl)carbonyl]oxy}- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(cc2)OC(=O)c1ccc(cc1)F)c1ccc(cc1)OC

STK839808
Synonyms: ethyl5- (2- {2- [(4- fluorophenyl)carbonyl]hydrazinyl}- 2- oxoethoxy)- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OCC(=O)NNC(=O)c1ccc(cc1)F)cc2

STK839810
Synonyms: (3- chloro- 6- methoxy- 1- benzothiophen- 2- yl)(3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: COc1ccc2c(c1)sc(c2Cl)C(=O)N1CCc2c(C1)cccc2

STK839811
Synonyms: 4- fluoro- N- {[2- (pyridin- 3- ylcarbonyl)hydrazinyl]carbonothioyl}benzamide
Smiles: S=C(NC(=O)c1ccc(cc1)F)NNC(=O)c1cccnc1

STK839813
Synonyms: 1,3- dimethyl- 7- (3- methylbenzyl)- 8- sulfanyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1cccc(c1)Cn1c(S)nc2c1c(=O)n(C)c(=O)n2C

STK538843
Synonyms: methyl3- {[(prop- 2- en- 1- yloxy)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: C=CCOC(=O)Nc1c([nH]c2c1cccc2)C(=O)OC

STK839814
Synonyms: 3- [(4- bromophenyl)carbonyl]- 4- hydroxy- 5H- spiro[furan- 2,2'- indene]- 1',3',5- trione
Smiles: Brc1ccc(cc1)C(=O)C1=C(O)C(=O)OC21C(=O)c1c(C2=O)cccc1

STK538851
Synonyms: 3,3- dimethyl- 8- (2- methylpropyl)- 6- {[2- (morpholin- 4- yl)ethyl]amino}- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: N#Cc1c(NCCN2CCOCC2)nc(c2c1CC(C)(C)OC2)CC(C)C

STK538855
Synonyms: (8R,8aR,11aS,11bS)- 8- acetyl- 10- (2- methoxy- 5- nitrophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@H]2C(=O)C)C=Cc2c1cccc2)[N+](=O)[O-]

STK538857
Synonyms: (2E)- N- (2,4- dichlorophenyl)- 2- (pyridin- 2- ylmethylidene)hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1Cl)Cl)N/N=C/c1ccccn1

STK538860
Synonyms: methyl4- amino- 1- heptyl- 2- oxo- 1,2- dihydroquinoline- 3- carboxylate
Smiles: CCCCCCCn1c2ccccc2c(c(c1=O)C(=O)OC)N

STK839822
Synonyms: 2- (2,8- dimethyl- 4- oxoquinolin- 1(4H)- yl)- N- (4- methylphenyl)acetamide
Smiles: O=C(Cn1c(C)cc(=O)c2c1c(C)ccc2)Nc1ccc(cc1)C

STK839824
Synonyms: (2E)- 2- (4- hydroxybenzylidene)- N- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)hydrazinecarboxamide
Smiles: O=C(NC12CC3CC(C2)CC(C1)C3)N/N=C/c1ccc(cc1)O

STK538867
Synonyms: ethyl6- bromo- 5- [2- oxo- 2- (propan- 2- yloxy)ethoxy]- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCC(=O)OC(C)C)c(c2)Br)c1ccccc1

STK839825
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 8- methyl- 4- oxo- 4H- chromen- 7- ylmorpholine- 4- carboxylate
Smiles: O=C(N1CCOCC1)Oc1ccc2c(c1C)occ(c2=O)c1nc2c(s1)cccc2

STK839826
Synonyms: ethyl6- methyl- 4- [(3- nitrophenyl)amino]quinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1cccc(c1)[N+](=O)[O-])cc(cc2)C

STK839829
Synonyms: 3- (4- {[5- (2- nitrophenyl)furan- 2- yl]carbonothioyl}piperazin- 1- yl)propanenitrile
Smiles: N#CCCN1CCN(CC1)C(=S)c1ccc(o1)c1ccccc1[N+](=O)[O-]

STK538880
Synonyms: 2,3- dimethoxy- 6- {2- [4- (phenylsulfanyl)phenyl]- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl}benzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1ccc(cc1)Sc1ccccc1

STK538882
Synonyms: 3,6- diamino- N- {2- [(4- chlorobenzyl)sulfanyl]phenyl}- 5- cyanothieno[2,3- b]pyridine- 2- carboxamide
Smiles: N#Cc1cc2c(nc1N)sc(c2N)C(=O)Nc1ccccc1SCc1ccc(cc1)Cl

STK538883
Synonyms: N'- [(E)- (2,4- dichlorophenyl)methylidene]- 6- oxo- 1,6- dihydropyridazine- 3- carbohydrazide
Smiles: Clc1ccc(c(c1)Cl)/C=N/NC(=O)c1ccc(=O)[nH]n1

STK538884
Synonyms: N- (2,2,2- trifluoroethyl)morpholine- 4- carboxamide
Smiles: O=C(N1CCOCC1)NCC(F)(F)F

STK839836
Synonyms: 3- amino- 5,7- dimethyl- 4a,5,7,7a- tetrahydroimidazo[4,5- e][1,3,4]thiadiazin- 6(1H)- one
Smiles: NC1=NNC2C(S1)N(C)C(=O)N2C

STK538887
Synonyms: methyl3- {[(2,6- dimethylmorpholin- 4- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CC(C)OC(C1)C)cccc2

STK538888
Synonyms: tetraethyl1,7- bis(acetylamino)heptane- 1,1,7,7- tetracarboxylate
Smiles: CCOC(=O)C(C(=O)OCC)(NC(=O)C)CCCCCC(C(=O)OCC)(C(=O)OCC)NC(=O)C

STK839844
Synonyms: ethyl2- tert- butyl- 5- [2- (4- fluorophenyl)- 2- oxoethoxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCC(=O)c3ccc(cc3)F)ccc2oc1C(C)(C)C

STK538896
Synonyms: 9- [(4- ethyl- 4- methyl- 1,3- dioxolan- 2- yl)methyl]- 9H- carbazole
Smiles: CCC1(C)COC(O1)Cn1c2ccccc2c2c1cccc2

STK839845
Synonyms: ethylN- {[(3- cyano- 4,6- dimethylpyridin- 2- yl)sulfanyl]acetyl}glycinate
Smiles: CCOC(=O)CNC(=O)CSc1nc(C)cc(c1C#N)C

STK538897
Synonyms: 6- [2- (5- bromothiophen- 2- yl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1ccc(s1)Br

STK839846
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- {[5- (ethoxymethyl)- 2- methylpyrimidin- 4- yl]amino}ethanone
Smiles: CCOCc1cnc(nc1NCC(=O)c1c(C)[nH]c2c1ccc(c2)C)C

STK538899
Synonyms: 9- methyl- 2- [(naphthalen- 1- yloxy)methyl]- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CN1CCc2c(C1)sc1c2c2nc(nn2cn1)COc1cccc2c1cccc2

STK839848
Synonyms: ethyl6- bromo- 5- {[(2E)- 4- ethoxy- 4- oxobut- 2- en- 1- yl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)/C=C/COc1cc2c(cc1Br)oc(c2C(=O)OCC)C

STK538900
Synonyms: 3- amino- 6- (3- methoxyphenyl)- N- [4- (trifluoromethoxy)phenyl]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1ccc(cc1)OC(F)(F)F

STK839849
Synonyms: 2- methoxyethyl2- methyl- 5- {[(3- nitrophenyl)carbonyl]oxy}- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1cccc(c1)[N+](=O)[O-]

STK538904
Synonyms: 6- tert- butyl- 2- {[2- (3- methoxyphenyl)- 2- oxoethyl]sulfanyl}- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: COc1cccc(c1)C(=O)CSc1nc2CCC(Cc2c(c1C#N)c1cccs1)C(C)(C)C

STK839853
Synonyms: ethyl5- (2- methoxy- 2- oxoethoxy)- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCC(=O)OC)cc2)c1ccc(cc1)OC

STK839855
Synonyms: 4- acetyl- 3- hydroxy- 5- (4- methoxyphenyl)- 1- (1,3- thiazol- 2- yl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: COc1ccc(cc1)C1N(c2nccs2)C(=O)C(=C1C(=O)C)O

STK839857
Synonyms: N- {[1- (3,4- dimethoxyphenyl)cyclohexyl]methyl}benzamide
Smiles: COc1cc(ccc1OC)C1(CCCCC1)CNC(=O)c1ccccc1

STK538915
Synonyms: (6aS,6bR,9aS,10R)- 8- (4- methoxyphenyl)- 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)OC)C=Cc1c2cccc1

STK538916
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (3,4,5- trimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cn2nnc(n2)N)cc(c1OC)OC

STK839859
Synonyms: 5- ethoxy- 2- phenyl- 1- benzofuran- 3- carboxamide
Smiles: CCOc1ccc2c(c1)c(C(=O)N)c(o2)c1ccccc1

STK839860
Synonyms: 2- (2- methyl- 4- oxoquinolin- 1(4H)- yl)- N- (3- methylphenyl)acetamide
Smiles: Cc1cccc(c1)NC(=O)Cn1c(C)cc(=O)c2c1cccc2

STK538921
Synonyms: 4- (morpholin- 4- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7(8H)- one
Smiles: O=c1[nH]cnc2c1sc1c2c2CCCc2c(n1)N1CCOCC1

STK538924
Synonyms: 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)N)C

STK839863
Synonyms: 4,6- dimethyl- 2- {(2E)- 2- [1- (4- nitrophenyl)ethylidene]hydrazinyl}pyrimidine
Smiles: C/C(=N\Nc1nc(C)cc(n1)C)/c1ccc(cc1)[N+](=O)[O-]

STK538928
Synonyms: ethyl5- (2- {2- [(4- methoxyphenyl)carbonyl]hydrazinyl}- 2- oxoethoxy)- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OCC(=O)NNC(=O)c1ccc(cc1)OC)cc2

STK538929
Synonyms: 2- [4- (5- chloro- 2- methylphenyl)piperazin- 1- yl]- 1- (5- methoxy- 1H- indol- 3- yl)ethanol
Smiles: COc1ccc2c(c1)c(c[nH]2)C(CN1CCN(CC1)c1cc(Cl)ccc1C)O

STK538931
Synonyms: 1- ethyl- 6- fluoro- 4- oxo- 7- [4- (tetrahydrofuran- 2- ylcarbonyl)piperazin- 1- yl]- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=O)C1CCCO1)c(c2)F

STK538935
Synonyms: 4- nitrobenzenesulfonylchloride
Smiles: [O-][N+](=O)c1ccc(cc1)S(=O)(=O)Cl

STK839868
Synonyms: N- (3- chlorophenyl)- 6- oxo- 1,6- dihydropyridazine- 3- carboxamide
Smiles: Clc1cccc(c1)NC(=O)c1ccc(=O)[nH]n1

STK839869
Synonyms: 9- methyl- 3- (2,2,2- trifluoroethyl)- 9H- carbazole
Smiles: Cn1c2ccc(cc2c2c1cccc2)CC(F)(F)F

STK538941
Synonyms: {[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}aceticacid
Smiles: OC(=O)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C

STK839871
Synonyms: 2- (2- {4- [(2E)- 3- (thiophen- 2- yl)prop- 2- enoyl]piperazin- 1- yl}ethyl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: O=C(N1CCN(CC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3)/C=C/c1cccs1

STK538947
Synonyms: ethyl5- (2- {2- [(3,4- dimethoxyphenyl)carbonyl]hydrazinyl}- 2- oxoethoxy)- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OCC(=O)NNC(=O)c1ccc(c(c1)OC)OC)cc2

STK839872
Synonyms: 3- ethyl6- methyl4- [(2,4- dimethylphenyl)amino]quinoline- 3,6- dicarboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(cc1C)C)cc(cc2)C(=O)OC

STK839874
Synonyms: (3- amino- 6- methyl- 5,6,7,8- tetrahydrothieno[2,3- b][1,6]naphthyridin- 2- yl)(4- methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)c1sc2c(c1N)cc1c(n2)CCN(C1)C

STK538952
Synonyms: 1- (ethylsulfanyl)- 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: CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)OC)CC(OC3)C(C)C

STK538954
Synonyms: 2- (4- nitrophenoxy)- N- [1- (phenylcarbonyl)- 1,2,3,4- tetrahydroquinolin- 6- yl]acetamide
Smiles: O=C(Nc1ccc2c(c1)CCCN2C(=O)c1ccccc1)COc1ccc(cc1)[N+](=O)[O-]

STK538967
Synonyms: 8- {[2- (dimethylamino)ethyl]amino}- 3- methyl- 7- (2- methylpropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(Cn1c(NCCN(C)C)nc2c1c(=O)[nH]c(=O)n2C)C

STK538969
Synonyms: 2- ({[(2E)- 3- (4- methylphenyl)prop- 2- enoyl]carbamothioyl}amino)- 4,5,6,7,8,9- hexahydrocycloocta[b]thiophene- 3- carboxamide
Smiles: O=C(NC(=S)Nc1sc2c(c1C(=O)N)CCCCCC2)/C=C/c1ccc(cc1)C

STK839881
Synonyms: N- cyclohexyl- 2- (4- methoxyphenyl)quinazolin- 4- amine
Smiles: COc1ccc(cc1)c1nc(NC2CCCCC2)c2c(n1)cccc2

STK538973
Synonyms: 2- (pyridin- 3- yl)- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: c1ccc(cn1)c1nn2c(n1)c1c(nc2)sc2c1CCC2

STK538974
Synonyms: 4- nitro- N- [1- (phenylcarbonyl)- 1,2,3,4- tetrahydroquinolin- 6- yl]benzamide
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])Nc1ccc2c(c1)CCCN2C(=O)c1ccccc1

STK538977
Synonyms: 2- [(1- {[4- (pyrrolidin- 1- ylsulfonyl)phenyl]carbonyl}piperidin- 4- yl)methyl]- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: O=C(c1ccc(cc1)S(=O)(=O)N1CCCC1)N1CCC(CC1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3

STK538978
Synonyms: 1- ethyl- 1H- perimidine
Smiles: CCn1cnc2c3c1cccc3ccc2

STK839886
Synonyms: 7- ethyl- 1,3- dimethyl- 8- {(2Z)- 2- [(3E)- 4- phenylbut- 3- en- 2- ylidene]hydrazinyl}- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(N/N=C(\C=C\c2ccccc2)/C)nc2c1c(=O)n(c(=O)n2C)C

STK538986
Synonyms: ethyl2- tert- butyl- 5- [(4- nitrobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCc3ccc(cc3)[N+](=O)[O-])ccc2oc1C(C)(C)C

STK538988
Synonyms: ethyl(3aS,4R,9aS,9bR)- 4- [(4- bromophenyl)carbonyl]- 2- (naphthalen- 1- yl)- 1,3- dioxo- 2,3,3a,4,9a,9b- hexahydro- 1H- pyrrolo[3,4- a]indolizine- 8- carboxylate
Smiles: CCOC(=O)C1=C[C@@H]2N(C=C1)[C@H]([C@@H]1[C@H]2C(=O)N(C1=O)c1cccc2c1cccc2)C(=O)c1ccc(cc1)Br

STK538994
Synonyms: N- (2- cyanophenyl)- 3- oxobutanamide
Smiles: N#Cc1ccccc1NC(=O)CC(=O)C

STK839897
Synonyms: (2E)- 3- (2,4- dimethoxyphenyl)- 1- (4- hydroxyphenyl)prop- 2- en- 1- one
Smiles: COc1cc(OC)ccc1/C=C/C(=O)c1ccc(cc1)O

STK839898
Synonyms: 2- [4- (1,3- benzothiazol- 2- yl)- 1H- pyrazol- 3- yl]- 5- [(4- nitrobenzyl)oxy]phenol
Smiles: Oc1cc(OCc2ccc(cc2)[N+](=O)[O-])ccc1c1n[nH]cc1c1nc2c(s1)cccc2

STK839899
Synonyms: methyl2- ({[2- amino- 1- (3- methoxypropyl)- 1H- pyrrolo[2,3- b]quinoxalin- 3- yl]carbonyl}amino)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COCCCn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2

STK539008
Synonyms: 8- {[2- (diethylamino)ethyl]amino}- 7- [3- (4- ethylphenoxy)- 2- hydroxypropyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCN(CCNc1nc2c(n1CC(COc1ccc(cc1)CC)O)c(=O)[nH]c(=O)n2C)CC

STK539012
Synonyms: 2- (pyridin- 4- yl)- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: n1ccc(cc1)c1nn2c(n1)c1c(nc2)sc2c1CCC2

STK539013
Synonyms: N'- [(1E)- 1- phenylpropylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: CC/C(=N\NC(=O)Cn1cncn1)/c1ccccc1

STK539014
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (1- ethyl- 3,5- dimethyl- 1H- pyrazol- 4- yl)methylidene]acetohydrazide
Smiles: CCn1nc(c(c1C)/C=N/NC(=O)CSc1nnc(n1C)c1cccc(c1)Br)C

STK839906
Synonyms: N- (3- acetylphenyl)- 2,2,3,3- tetrafluoro- 3- (trifluoromethoxy)propanamide
Smiles: O=C(C(C(OC(F)(F)F)(F)F)(F)F)Nc1cccc(c1)C(=O)C

STK539016
Synonyms: 7- {4- [(4- bromophenyl)sulfonyl]piperazin- 1- yl}- 1- ethyl- 6- fluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)c(c2)F

STK539019
Synonyms: (2E)- 3- (3- {[(2,4,6- trimethylphenyl)sulfonyl]amino}phenyl)prop- 2- enoicacid
Smiles: OC(=O)/C=C/c1cccc(c1)NS(=O)(=O)c1c(C)cc(cc1C)C

STK539020
Synonyms: 2,3- dimethoxy- 6- [2- (4- phenoxyphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]benzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1ccc(cc1)Oc1ccccc1

STK839907
Synonyms: ethyl{[3- methyl- 7- (3- methylbutyl)- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C

STK839908
Synonyms: 2- [3- (1H- imidazol- 1- yl)propyl]- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: O=c1c2cccc3c2c(c(=O)n1CCCn1cncc1)ccc3

STK839909
Synonyms: 2- (2- {4- [(2E)- 3- (4- fluorophenyl)prop- 2- enoyl]piperazin- 1- yl}ethyl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: Fc1ccc(cc1)/C=C/C(=O)N1CCN(CC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK839910
Synonyms: N- {[2- (furan- 2- ylcarbonyl)hydrazinyl]carbonothioyl}- 4- methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)NC(=S)NNC(=O)c1ccco1

STK539031
Synonyms: 4,6- dimethyl- 2- {(2E)- 2- [(5- nitrothiophen- 2- yl)methylidene]hydrazinyl}pyrimidine
Smiles: Cc1nc(N/N=C/c2ccc(s2)[N+](=O)[O-])nc(c1)C

STK539032
Synonyms: 2- {2- methoxy- 4- [(E)- (2- {[4- (1H- tetrazol- 1- yl)phenoxy]acetyl}hydrazinylidene)methyl]phenoxy}acetamide
Smiles: COc1cc(/C=N/NC(=O)COc2ccc(cc2)n2cnnn2)ccc1OCC(=O)N

STK539036
Synonyms: ethyl6- bromo- 5- {[(2- bromophenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OC(=O)c1ccccc1Br)c(c2)Br

STK539047
Synonyms: [(7- ethyl- 3- methyl- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl)sulfanyl]aceticacid
Smiles: CCn1c(SCC(=O)O)nc2c1c(=O)[nH]c(=O)n2C

STK539053
Synonyms: 7- (4- dodecanoylpiperazin- 1- yl)- 1- ethyl- 6- fluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCCCCCCCCCCC(=O)N1CCN(CC1)c1cc2n(CC)cc(c(=O)c2cc1F)C(=O)O

STK839922
Synonyms: 3- [8- (benzylamino)- 1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl]propanenitrile
Smiles: N#CCCn1c(NCc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK539062
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (3,5- dibromo- 2- hydroxyphenyl)methylidene]acetohydrazide
Smiles: Brc1cc(/C=N/NC(=O)Cn2nnc(n2)N)c(c(c1)Br)O

STK539065
Synonyms: 1,3- dimethyl- 8- [(2E)- 2- (2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)hydrazinyl]- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(N/N=C\2/C(=O)Nc3c2cccc3)nc2c1c(=O)n(c(=O)n2C)C

STK839926
Synonyms: 2- (3- nitrophenyl)- 2- oxoethyl(2E)- 3- (furan- 2- yl)prop- 2- enoate
Smiles: O=C(OCC(=O)c1cccc(c1)[N+](=O)[O-])/C=C/c1ccco1

STK539077
Synonyms: ethyl1,2- dimethyl- 5- {[2- (trifluoromethyl)benzyl]oxy}- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1cc(OCc1ccccc1C(F)(F)F)cc2)C

STK539080
Synonyms: 4- {[(3- cyano- 4,6- dimethylpyridin- 2- yl)sulfanyl]methyl}benzoicacid
Smiles: N#Cc1c(C)cc(nc1SCc1ccc(cc1)C(=O)O)C

STK839927
Synonyms: ethyl2- (4- methoxyphenyl)- 5- [(2- methylbenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1ccccc1C)cc2)c1ccc(cc1)OC

STK839928
Synonyms: 2- (2- {4- [(2E)- 3- (4- chlorophenyl)prop- 2- enoyl]piperazin- 1- yl}ethyl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)/C=C/C(=O)N1CCN(CC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK839929
Synonyms: ethyl6- bromo- 2- tert- butyl- 5- [(4- fluorobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCc3ccc(cc3)F)c(cc2oc1C(C)(C)C)Br

STK539087
Synonyms: 1,3- diethyl- 5- [(2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: CCN1C(=O)C(=C/C=C/c2ccco2)C(=O)N(C1=S)CC

STK839933
Synonyms: [4- amino- 2- (prop- 2- en- 1- ylamino)- 1,3- thiazol- 5- yl](5- chlorothiophen- 2- yl)methanone
Smiles: C=CCNc1nc(c(s1)C(=O)c1ccc(s1)Cl)N

STK539092
Synonyms: ethyl2- tert- butyl- 5- {[(4- fluorophenyl)carbonyl]oxy}- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(ccc2oc1C(C)(C)C)OC(=O)c1ccc(cc1)F

STK539093
Synonyms: 2- hydrazinyl- 3- (4- methoxyphenyl)- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: NNc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CC(OC3)C(C)C

STK539094
Synonyms: [3- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)propyl](hydroxymethyl)phosphinicacid
Smiles: OCP(=O)(CCCN1C(=O)c2c(C1=O)cccc2)O

STK539095
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(E)- (6- methylpyridin- 2- yl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnnc1N)N/N=C/c1cccc(n1)C

STK539096
Synonyms: 6- [9- bromo- 2- (2- methoxyphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1c(OC)ccc(c1C(=O)O)C1Oc2ccc(cc2C2N1N=C(C2)c1ccccc1OC)Br

STK839935
Synonyms: 2- (8- methoxy- 2- methyl- 4- oxoquinolin- 1(4H)- yl)- N- phenylacetamide
Smiles: COc1cccc2c1n(CC(=O)Nc1ccccc1)c(C)cc2=O

STK539104
Synonyms: methyl5- chloro- 3- {[2- (3,3- dimethylpiperidin- 1- yl)propanoyl](methyl)amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1N(C(=O)C(N1CCCC(C1)(C)C)C)C)cc(cc2)Cl

STK539109
Synonyms: 3a- {4- [oxo(phenyl)acetyl]phenyl}- 6a- phenyltetrahydroimidazo[4,5- d]imidazole- 2,5(1H,3H)- dione
Smiles: O=C1NC2(C(N1)(NC(=O)N2)c1ccc(cc1)C(=O)C(=O)c1ccccc1)c1ccccc1

STK539111
Synonyms: 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N'- [(E)- thiophen- 2- ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1cccs1

STK839939
Synonyms: ethyl2- methyl- 5- [(3- nitrobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OCc1cccc(c1)[N+](=O)[O-])cc2

STK539113
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- {2- [(4- bromobenzyl)oxy]phenyl}methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1ccccc1OCc1ccc(cc1)Br

STK539114
Synonyms: 1- ethyl- 6- fluoro- 7- [4- (2- methylpropanoyl)piperazin- 1- yl]- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=O)C(C)C)c(c2)F

STK839942
Synonyms: 2- methoxyethyl6- bromo- 5- [2- (4- methoxyphenyl)- 2- oxoethoxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCC(=O)c1ccc(cc1)OC)c(c2)Br

STK539123
Synonyms: 7- {4- [(4- chlorophenyl)sulfonyl]piperazin- 1- yl}- 1- ethyl- 6- fluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)S(=O)(=O)c1ccc(cc1)Cl)c(c2)F

STK539124
Synonyms: 2- {[3- (4- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N- (4- methylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK539126
Synonyms: 6- [2- (4- hydroxy- 3- methoxyphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1c(OC)ccc(c1C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1ccc(c(c1)OC)O

STK539130
Synonyms: 3- methyl- 7- (2- phenylethyl)- 8- {[2- (piperidin- 1- yl)ethyl]sulfanyl}- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=c1[nH]c(=O)n(c2c1n(CCc1ccccc1)c(n2)SCCN1CCCCC1)C

STK539137
Synonyms: 1- (4- hydroxy- 3- methylphenyl)- 2- [(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]propan- 1- one
Smiles: CC(C(=O)c1ccc(c(c1)C)O)Sc1nnnn1c1ccccc1

STK839947
Synonyms: 7- [2- hydroxy- 3- (4- methoxyphenoxy)propyl]- 1,3- dimethyl- 8- (prop- 2- en- 1- ylamino)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCNc1nc2c(n1CC(COc1ccc(cc1)OC)O)c(=O)n(c(=O)n2C)C

STK539142
Synonyms: methyl5- methyl- 3- {[(prop- 2- en- 1- yloxy)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: C=CCOC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC

STK839949
Synonyms: 8- (dimethylamino)- 3- methyl- 7- (3- methylbenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1cccc(c1)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N(C)C

STK539144
Synonyms: (2E)- 3- (naphthalen- 1- yl)- 1- [2- (prop- 2- en- 1- ylsulfanyl)- 1H- benzimidazol- 1- yl]prop- 2- en- 1- one
Smiles: C=CCSc1nc2c(n1C(=O)/C=C/c1cccc3c1cccc3)cccc2

STK539145
Synonyms: 2'- amino- 1- ethyl- 7',9'- dimethylspiro[piperidine- 4,4'- pyrano[2',3':4,5]thieno[2,3- b]pyridine]- 3'- carbonitrile
Smiles: CCN1CCC2(CC1)C(=C(N)Oc1c2sc2c1c(C)cc(n2)C)C#N

STK839952
Synonyms: N'- {(E)- [4- (diethylamino)phenyl]methylidene}- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: CCN(c1ccc(cc1)/C=N/NC(=O)CSc1ccccn1)CC

STK539148
Synonyms: 3- amino- 6- (3- methoxyphenyl)- N- (4- methyl- 1,3- thiazol- 2- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1scc(n1)C

STK539159
Synonyms: ethyl5- [2- oxo- 2- (prop- 2- en- 1- yloxy)ethoxy]- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: C=CCOC(=O)COc1ccc2c(c1)c(C(=O)OCC)c(o2)c1ccccc1

STK539161
Synonyms: 3- amino- N- (2- methoxyphenyl)- 6- (3- methoxyphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1ccccc1OC

STK539164
Synonyms: {[3- cyano- 4- (4- methoxyphenyl)- 6- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}(phenyl)aceticacid
Smiles: COc1ccc(cc1)c1cc(nc(c1C#N)SC(c1ccccc1)C(=O)O)c1cccs1

STK839955
Synonyms: 4- hydroxy- 1- methyl- N- (4- methylbenzyl)- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: Cc1ccc(cc1)CNC(=O)c1c(O)c2ccccc2n(c1=O)C

STK539166
Synonyms: N'- [(E)- 1,3- benzodioxol- 5- ylmethylidene]- 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/c1ccc2c(c1)OCO2

STK839957
Synonyms: 2- ({1- [(2E)- 3- (1,3- benzodioxol- 5- yl)prop- 2- enoyl]piperidin- 4- yl}methyl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: O=C(N1CCC(CC1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3)/C=C/c1ccc2c(c1)OCO2

STK539169
Synonyms: 2- (4- cyclohexylpiperazin- 1- yl)- 1- (2,6- dimethyl- 1H- indol- 3- yl)ethanone
Smiles: Cc1ccc2c(c1)[nH]c(c2C(=O)CN1CCN(CC1)C1CCCCC1)C

STK539171
Synonyms: 6- amino- 5- [3- (diethylamino)propyl]- 5H- pyrrolo[2,3- b]pyrazine- 2,3,7- tricarbonitrile
Smiles: CCN(CCCn1c(N)c(c2c1nc(C#N)c(n2)C#N)C#N)CC

STK539173
Synonyms: N,N- dicyclohexyl- 2,2,3,3,4,4,5,5,5- nonafluoropentanamide
Smiles: O=C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)N(C1CCCCC1)C1CCCCC1

STK839959
Synonyms: 7- (2,3- dihydroxypropyl)- 1,3- dimethyl- 8- (pyrrolidin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCC(Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCC1)O

STK539177
Synonyms: methyl3- {[(2- fluorophenyl)carbonyl]amino}- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1ccccc1F)cc(cc2)C

STK839961
Synonyms: 7- hexyl- 1,3- dimethyl- 8- (morpholin- 4- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCOCC1

STK539184
Synonyms: 2- (8- methyl- 1,2,3a,4,5,6- hexahydro- 3H- pyrazino[3,2,1- jk]carbazol- 3- yl)- N'- [(Z)- (4- nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCn2c3C1CCCc3c1c2ccc(c1)C)N/N=C\c1ccc(cc1)[N+](=O)[O-]

STK539186
Synonyms: methyl5- chloro- 3- {[(prop- 2- en- 1- yloxy)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1c(NC(=O)OCC=C)c2c([nH]1)ccc(c2)Cl

STK839965
Synonyms: 4- acetyl- 5- (4- bromophenyl)- 3- hydroxy- 1- [3- (1H- imidazol- 1- yl)propyl]- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Brc1ccc(cc1)C1N(CCCn2cncc2)C(=O)C(=C1C(=O)C)O

STK539190
Synonyms: 6- bromo- 2- tert- butyl- 5- hydroxy- 1- benzofuran- 3- carboxylicacid
Smiles: Brc1cc2oc(c(c2cc1O)C(=O)O)C(C)(C)C

STK539195
Synonyms: methyl5- fluoro- 3- {[(2- fluorophenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1ccccc1F)cc(cc2)F

STK839971
Synonyms: 7- (2,3- dihydroxypropyl)- 1,3- dimethyl- 8- (piperidin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCC(Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCCCC1)O

STK539200
Synonyms: 3- bromo- N- [1- (phenylcarbonyl)- 1,2,3,4- tetrahydroquinolin- 6- yl]benzamide
Smiles: Brc1cccc(c1)C(=O)Nc1ccc2c(c1)CCCN2C(=O)c1ccccc1

STK539201
Synonyms: 2- phenyl- N'- [(E)- thiophen- 2- ylmethylidene]quinoline- 4- carbohydrazide
Smiles: O=C(c1cc(nc2c1cccc2)c1ccccc1)N/N=C/c1cccs1

STK539202
Synonyms: (2E)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- (3- hydroxy- 4- methoxyphenyl)prop- 2- enenitrile
Smiles: N#C/C(=C\c1ccc(c(c1)O)OC)/c1scc(n1)c1ccc2c(c1)OCO2

STK539203
Synonyms: 6- [9- bromo- 2- (5- methylfuran- 2- yl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)C1Oc2ccc(cc2C2N1N=C(C2)c1ccc(o1)C)Br

STK839974
Synonyms: 8- (butan- 2- ylamino)- 1,3- dimethyl- 7- (4- methylbenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCC(Nc1nc2c(n1Cc1ccc(cc1)C)c(=O)n(c(=O)n2C)C)C

STK839975
Synonyms: 2- [(3,4- dimethylphenyl)(phenyl)methylidene]- 1H- indene- 1,3(2H)- dione
Smiles: Cc1cc(ccc1C)/C(=C/1\C(=O)c2c(C1=O)cccc2)/c1ccccc1

STK539204
Synonyms: 2- {[4- chloro- 6- (octylamino)- 1,3,5- triazin- 2- yl]amino}ethanol
Smiles: CCCCCCCCNc1nc(Cl)nc(n1)NCCO

STK839978
Synonyms: ethyl2- tert- butyl- 5- hydroxy- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(O)cc2)C(C)(C)C

STK839980
Synonyms: ethyl3- {[(thiophen- 2- ylcarbonyl)carbamothioyl]amino}benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=S)NC(=O)c1cccs1

STK839981
Synonyms: ethyl5- [2- (4- methoxyphenyl)- 2- oxoethoxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OCC(=O)c1ccc(cc1)OC)cc2

STK539207
Synonyms: 3- amino- N- (4- fluorophenyl)- 6- (3- methoxyphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1ccc(cc1)F

STK539209
Synonyms: [(3- cyano- 6- ethyl- 5- methylpyridin- 2- yl)sulfanyl]aceticacid
Smiles: N#Cc1cc(C)c(nc1SCC(=O)O)CC

STK539211
Synonyms: 2- {[3- cyano- 6- phenyl- 4- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- N- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)acetamide
Smiles: N#Cc1c(SCC(=O)NC23CC4CC(C3)CC(C2)C4)nc(cc1c1cccs1)c1ccccc1

STK539214
Synonyms: 3- [3- acetyl- 4- hydroxy- 2- (4- nitrophenyl)- 5- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl]benzoicacid
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1cccc(c1)C(=O)O

STK539222
Synonyms: 2- cyclopropyl- N'- [(1E)- 1- (4- methylphenyl)ethylidene]quinoline- 4- carbohydrazide
Smiles: Cc1ccc(cc1)/C(=N/NC(=O)c1cc(nc2c1cccc2)C1CC1)/C

STK539223
Synonyms: 1- amino- 5- (propan- 2- yl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxylicacid
Smiles: CC(c1nc2sc(c(c2c2c1CCCC2)N)C(=O)O)C

STK539226
Synonyms: {[3- cyano- 6- (thiophen- 2- yl)- 4- (trifluoromethyl)pyridin- 2- yl]sulfanyl}(phenyl)aceticacid
Smiles: N#Cc1c(SC(c2ccccc2)C(=O)O)nc(cc1C(F)(F)F)c1cccs1

STK839988
Synonyms: methyl5- {[(2- bromophenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1ccccc1Br

STK839989
Synonyms: ethyl2- (4- methoxyphenyl)- 5- [(thiophen- 2- ylcarbonyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(cc2)OC(=O)c1cccs1)c1ccc(cc1)OC

STK839992
Synonyms: methyl6- bromo- 2- methyl- 5- [(3- nitrobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: COC(=O)c1c(C)oc2c1cc(OCc1cccc(c1)[N+](=O)[O-])c(c2)Br

STK839993
Synonyms: ethyl2- tert- butyl- 5- [(2,5- dimethylbenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCc3cc(C)ccc3C)ccc2oc1C(C)(C)C

STK539236
Synonyms: 3- {[(E)- (2- hydroxy- 3- methoxyphenyl)methylidene]amino}- 2- propylquinazolin- 4(3H)- one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1cccc(c1O)OC

STK839994
Synonyms: 3- (4- {[5- (2,5- dichlorophenyl)furan- 2- yl]carbonothioyl}piperazin- 1- yl)propanenitrile
Smiles: N#CCCN1CCN(CC1)C(=S)c1ccc(o1)c1cc(Cl)ccc1Cl

STK539243
Synonyms: 3- amino- N- (1,3- benzodioxol- 5- yl)- 6- (3- methoxyphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1ccc2c(c1)OCO2

STK539248
Synonyms: N'- [(E)- {2- [(4- bromobenzyl)oxy]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/c1ccccc1OCc1ccc(cc1)Br

STK539254
Synonyms: 8- (hexylamino)- 3- methyl- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCn1c(NCCCCCC)nc2c1c(=O)[nH]c(=O)n2C

STK539255
Synonyms: ethyl2- {[(4- methoxyphenyl)carbamoyl]amino}- 5- (propan- 2- yl)- 4,7- dihydro- 5H- thieno[2,3- c]pyran- 3- carboxylate
Smiles: CCOC(=O)c1c(NC(=O)Nc2ccc(cc2)OC)sc2c1CC(OC2)C(C)C

STK840000
Synonyms: 7- (2- chlorobenzyl)- 8- [(2- methoxyethyl)sulfanyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COCCSc1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C

STK539259
Synonyms: 2,5- bis[(dimethylamino)methyl]- 1,6- diphenylhexane- 1,6- dione
Smiles: CN(CC(C(=O)c1ccccc1)CCC(C(=O)c1ccccc1)CN(C)C)C

STK539276
Synonyms: 1,3- dimethyl- 8- (morpholin- 4- yl)- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCOCC1

STK840007
Synonyms: 2- [(4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (4- phenoxyphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Oc1ccccc1)COc1ccc2c(c1)oc(=O)cc2C

STK539280
Synonyms: (8- hydroxynaphthalen- 1- yl)(piperidin- 1- yl)methanone
Smiles: O=C(c1cccc2c1c(O)ccc2)N1CCCCC1

STK539287
Synonyms: [3- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)propyl](2- phenylethyl)phosphinicacid
Smiles: O=C1N(CCCP(=O)(CCc2ccccc2)O)C(=O)c2c1cccc2

STK539289
Synonyms: methyl5- chloro- 3- ({2- [(1R,5R)- 8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl]propanoyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C(N1C[C@@H]3C[C@H](C1)c1n(C3)c(=O)ccc1)C)cc(cc2)Cl

STK539292
Synonyms: ([(2,4- dichlorophenyl)amino]{[2- (4- methylphenyl)- 2- oxoethyl]sulfanyl}methylidene)propanedinitrile
Smiles: N#CC(=C(Nc1ccc(cc1Cl)Cl)SCC(=O)c1ccc(cc1)C)C#N

STK539294
Synonyms: 3- {[(E)- (2,4- dihydroxyphenyl)methylidene]amino}- 2- propylquinazolin- 4(3H)- one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1ccc(cc1O)O

STK840014
Synonyms: propan- 2- yl5- [(6- bromo- 2- methoxynaphthalen- 1- yl)methoxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COc1ccc2c(c1COc1ccc3c(c1)c(C(=O)OC(C)C)c(o3)C)ccc(c2)Br

STK539296
Synonyms: (8- hydroxynaphthalen- 1- yl)(morpholin- 4- yl)methanone
Smiles: O=C(c1cccc2c1c(O)ccc2)N1CCOCC1

STK840015
Synonyms: (2E)- 2- cyano- 3- (1- {2- [(furan- 2- ylmethyl)amino]- 2- oxoethyl}- 1H- indol- 3- yl)- N- methylprop- 2- enamide
Smiles: N#C/C(=C\c1cn(c2c1cccc2)CC(=O)NCc1ccco1)/C(=O)NC

STK840017
Synonyms: 1,3- dimethyl- 8- (methylamino)- 7- (2- phenylethyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CNc1nc2c(n1CCc1ccccc1)c(=O)n(c(=O)n2C)C

STK539307
Synonyms: N'- [(E)- (2- hydroxy- 5- nitrophenyl)methylidene]- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1cc(ccc1O)[N+](=O)[O-]

STK840018
Synonyms: (2Z)- 3- amino- 2- [(Z)- (3- oxo- 1,3- dihydro- 2H- indol- 2- ylidene)methyl]- 3- [(2- phenylethyl)amino]prop- 2- enenitrile
Smiles: N#C/C(=C(\NCCc1ccccc1)/N)/C=C/1\Nc2c(C1=O)cccc2

STK539311
Synonyms: 6- [2- (4- chlorophenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1c(OC)ccc(c1C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1ccc(cc1)Cl

STK840021
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 8- methyl- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- yl4- methoxybenzoate
Smiles: COc1ccc(cc1)C(=O)Oc1ccc2c(c1C)oc(c(c2=O)c1nc2c(s1)cccc2)C(F)(F)F

STK539319
Synonyms: 6- oxo- 1,6- dihydropyridazine- 3- carbohydrazide
Smiles: NNC(=O)c1ccc(=O)[nH]n1

STK840023
Synonyms: N- (4- fluorophenyl)- 6- oxo- 1,6- dihydropyridazine- 3- carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1ccc(=O)[nH]n1

STK840025
Synonyms: benzyl2- amino- 3- cyano- 5- oxo- 5,6,7,8- tetrahydro- 1'H- spiro[chromene- 4,4'- piperidine]- 1'- carboxylate
Smiles: N#CC1=C(N)OC2=C(C31CCN(CC3)C(=O)OCc1ccccc1)C(=O)CCC2

STK539325
Synonyms: methyl6- bromo- 5- [(3- bromobenzyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COC(=O)c1c(C)oc2c1cc(OCc1cccc(c1)Br)c(c2)Br

STK840026
Synonyms: 2- methoxyethyl6- bromo- 5- [(4- bromobenzyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCc1ccc(cc1)Br)c(c2)Br

STK840029
Synonyms: 2- methoxyethyl5- (3,3- dimethyl- 2- oxobutoxy)- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCC(=O)C(C)(C)C)cc2

STK539341
Synonyms: 4- acetyl- 5- (4- chlorophenyl)- 3- hydroxyfuran- 2(5H)- one
Smiles: Clc1ccc(cc1)C1OC(=O)C(=C1C(=O)C)O

STK539346
Synonyms: ethyl6- bromo- 5- {[(2E)- 4- ethoxy- 4- oxobut- 2- en- 1- yl]oxy}- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OC/C=C/C(=O)OCC)c(c2)Br)c1ccccc1

STK840035
Synonyms: 7- methyl- 4- (morpholin- 4- yl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine
Smiles: CC1CCc2c(C1)sc1c2c(ncn1)N1CCOCC1

STK539352
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- (4- ethylpiperazin- 1- yl)ethanone
Smiles: CCN1CCN(CC1)CC(=O)c1c(C)[nH]c2c1ccc(c2)C

STK539355
Synonyms: ethyl6- bromo- 2- tert- butyl- 5- [2- (4- methoxyphenyl)- 2- oxoethoxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCC(=O)c3ccc(cc3)OC)c(cc2oc1C(C)(C)C)Br

STK840036
Synonyms: ethyl2- tert- butyl- 5- [(2- fluorobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCc3ccccc3F)ccc2oc1C(C)(C)C

STK840042
Synonyms: (2E)- 2- cyano- N- (furan- 2- ylmethyl)- 3- (1- {2- [(furan- 2- ylmethyl)amino]- 2- oxoethyl}- 1H- indol- 3- yl)prop- 2- enamide
Smiles: N#C/C(=C\c1cn(c2c1cccc2)CC(=O)NCc1ccco1)/C(=O)NCc1ccco1

STK840044
Synonyms: ethyl6- bromo- 5- {[(3,4- dimethoxyphenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OC(=O)c1ccc(c(c1)OC)OC)c(c2)Br

STK539363
Synonyms: 8,8- dimethyl- 5- (morpholin- 4- yl)- 8,9- dihydro- 6H- pyrano[4,3- d][1,2]thiazolo[5,4- b]pyridin- 1- amine
Smiles: Nc1nsc2c1c1CC(C)(C)OCc1c(n2)N1CCOCC1

STK539364
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(E)- (5- methylfuran- 2- yl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnnc1N)N/N=C/c1ccc(o1)C

STK539366
Synonyms: 7- (2,3- dihydroxypropyl)- 1,3- dimethyl- 8- [(2- phenylethyl)amino]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCC(Cn1c(NCCc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C)O

STK539372
Synonyms: 4- hydroxy- 2- oxo- N- [2- (piperazin- 1- yl)ethyl]- 1- propyl- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCCn1c(=O)c(C(=O)NCCN2CCNCC2)c(c2c1cccc2)O

STK840048
Synonyms: 7- (2,3- dihydroxypropyl)- 3- methyl- 8- (pyrrolidin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCCC1)O

STK539374
Synonyms: propan- 2- yl{[6- amino- 3,5- dicyano- 4- (3,4,5- trimethoxyphenyl)pyridin- 2- yl]sulfanyl}acetate
Smiles: N#Cc1c(SCC(=O)OC(C)C)nc(c(c1c1cc(OC)c(c(c1)OC)OC)C#N)N

STK539375
Synonyms: 6- (9- bromo- 2- phenyl- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl)- 2,3- dimethoxybenzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)C1Oc2ccc(cc2C2N1N=C(C2)c1ccccc1)Br

STK840050
Synonyms: 2- [(5- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]- 1- phenylethanone
Smiles: O=C(c1ccccc1)CSc1nnc2n1c(C)nc1c2c2CCCCc2s1

STK840054
Synonyms: 3- methyl- 7- pentyl- 8- (prop- 2- en- 1- ylamino)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCn1c(NCC=C)nc2c1c(=O)[nH]c(=O)n2C

STK539387
Synonyms: (2Z)- 3- amino- 3- (4- methylpiperazin- 1- yl)- 2- [(Z)- (3- oxo- 1,3- dihydro- 2H- indol- 2- ylidene)methyl]prop- 2- enenitrile
Smiles: N#C/C(=C(\N1CCN(CC1)C)/N)/C=C/1\Nc2c(C1=O)cccc2

STK539391
Synonyms: ethyl5- [2- (benzyloxy)- 2- oxoethoxy]- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCC(=O)OCc1ccccc1)cc2)c1ccc(cc1)OC

STK539395
Synonyms: 4- ethoxy- 3- (4- nitrophenyl)- 1- phenyl- 1,4,5,6- tetrahydrofuro[3,2- e][1,2,4]diazaphosphinine4- oxide
Smiles: CCOP1(=O)C2=C(OCC2)N(N=C1c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK840057
Synonyms: 2,6- dimethyl- 3- (morpholin- 4- ylmethyl)quinolin- 4(1H)- one
Smiles: Cc1[nH]c2ccc(cc2c(=O)c1CN1CCOCC1)C

STK840058
Synonyms: 2- methoxyethyl6- bromo- 5- (2- ethoxy- 2- oxoethoxy)- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCC(=O)OCC)c(c2)Br

STK539401
Synonyms: 6- hydroxy- 4- oxo- N- [2- (piperazin- 1- yl)ethyl]- 1,2- dihydro- 4H- pyrrolo[3,2,1- ij]quinoline- 5- carboxamide
Smiles: O=C(c1c(O)c2cccc3c2n(c1=O)CC3)NCCN1CCNCC1

STK840060
Synonyms: 8- [(furan- 2- ylmethyl)amino]- 3- methyl- 7- (2- methylpropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(Cn1c(NCc2ccco2)nc2c1c(=O)[nH]c(=O)n2C)C

STK539402
Synonyms: 6- [2- (4- fluorophenyl)- 7- methoxy- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1cccc2c1OC(N1C2CC(=N1)c1ccc(cc1)F)c1ccc(c(c1C(=O)O)OC)OC

STK539405
Synonyms: 2,3- dimethoxy- 6- [2- (naphthalen- 1- yl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]benzoicacid
Smiles: COc1c(OC)ccc(c1C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1cccc2c1cccc2

STK539407
Synonyms: 6- methyl- 4- oxo- 5- phenyl- 3- (pyridin- 2- ylmethyl)- 4,5- dihydro- 3H- pyrrolo[3,2- d]pyrimidine- 7- carbonitrile
Smiles: N#Cc1c(C)n(c2c1ncn(c2=O)Cc1ccccn1)c1ccccc1

STK840062
Synonyms: (5E)- 2- (piperidin- 1- yl)- 5- [4- (propan- 2- yloxy)benzylidene]- 1,3- thiazol- 4(5H)- one
Smiles: CC(Oc1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCCCC1)C

STK539409
Synonyms: 2- methoxyethyl6- bromo- 2- methyl- 5- [2- oxo- 2- (prop- 2- en- 1- yloxy)ethoxy]- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCC(=O)OCC=C)c(c2)Br

STK539411
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- {(E)- [2- (benzyloxy)phenyl]methylidene}acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1ccccc1OCc1ccccc1

STK840063
Synonyms: ethyl2- tert- butyl- 5- [(4- chlorobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCc3ccc(cc3)Cl)ccc2oc1C(C)(C)C

STK840065
Synonyms: ethyl6- bromo- 2- tert- butyl- 5- [(4- nitrobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1ccc(cc1)[N+](=O)[O-])c(c2)Br)C(C)(C)C

STK539421
Synonyms: ethyl3- ethyl- 4- [(phenylcarbonyl)amino]- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carboxylate
Smiles: CCn1c(=S)sc(c1NC(=O)c1ccccc1)C(=O)OCC

STK840069
Synonyms: 7- [(4- methylphenyl)amino]- 8H- naphtho[2,3- a]phenothiazine- 8,13(14H)- dione
Smiles: Cc1ccc(cc1)Nc1cc2sc3ccccc3[nH]c2c2c1c(=O)c1ccccc1c2=O

STK539428
Synonyms: 6- chloro- 2- methyl- 3- (morpholin- 4- ylmethyl)quinolin- 4- ol
Smiles: Clc1ccc2c(c1)c(O)c(c(n2)C)CN1CCOCC1

STK539436
Synonyms: 8- (ethylamino)- 7- hexyl- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCn1c(NCC)nc2c1c(=O)n(C)c(=O)n2C

STK539439
Synonyms: 2'- amino- 7',9'- dimethyl- 1- propylspiro[piperidine- 4,4'- pyrano[2',3':4,5]thieno[2,3- b]pyridine]- 3'- carbonitrile
Smiles: CCCN1CCC2(CC1)C(=C(N)Oc1c2sc2c1c(C)cc(n2)C)C#N

STK539440
Synonyms: 2- (4- methoxyphenyl)- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccc(cc1)c1nn2c(n1)c1c(nc2)sc2c1CCC2

STK840075
Synonyms: ethyl2- methyl- 5- [(phenylcarbonyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1ccccc1

STK840076
Synonyms: 2- methoxyethyl6- bromo- 5- {[(4- fluorophenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OC(=O)c1ccc(cc1)F)c(c2)Br

STK539444
Synonyms: 3,6- diamino- 5- cyano- N- [2- (3,4- dimethoxyphenyl)ethyl]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cc(CCNC(=O)c2sc3c(c2N)cc(c(n3)N)C#N)ccc1OC

STK840077
Synonyms: propan- 2- yl5- (2- ethoxy- 2- oxo- 1- phenylethoxy)- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)C(c1ccccc1)Oc1ccc2c(c1)c(C(=O)OC(C)C)c(o2)C

STK539445
Synonyms: N'- [(E)- (2,4- dimethoxyphenyl)methylidene]- 6- oxo- 1,6- dihydropyridazine- 3- carbohydrazide
Smiles: COc1cc(OC)ccc1/C=N/NC(=O)c1ccc(=O)[nH]n1

STK539449
Synonyms: N- [2,5- dioxo- 1- (1,3- thiazol- 2- yl)pyrrolidin- 3- yl]- 2,2,3,3,4,4,4- heptafluoro- N- (4- fluorobenzyl)butanamide
Smiles: Fc1ccc(cc1)CN(C(=O)C(C(C(F)(F)F)(F)F)(F)F)C1CC(=O)N(C1=O)c1nccs1

STK539453
Synonyms: methyl1- (1,3- benzodioxol- 5- ylmethyl)- 5- bromo- 6- oxo- 1,6- dihydropyridine- 3- carboxylate
Smiles: COC(=O)c1cn(Cc2ccc3c(c2)OCO3)c(=O)c(c1)Br

STK539454
Synonyms: N'- [(1Z)- 1- phenylethylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1cncn1)N/N=C(\c1ccccc1)/C

STK539455
Synonyms: 7- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- N- (4- methylphenyl)heptanamide
Smiles: O=C(Nc1ccc(cc1)C)CCCCCCN1C(=O)c2c(C1=O)cccc2

STK539457
Synonyms: ethyl6- bromo- 5- [(3- nitrobenzyl)oxy]- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1cccc(c1)[N+](=O)[O-])c(c2)Br)c1ccccc1

STK840078
Synonyms: 7- [(2- chloro- 6- fluorobenzyl)oxy]- 3- (pyridin- 2- yl)- 2H- chromen- 2- one
Smiles: Fc1cccc(c1COc1ccc2c(c1)oc(=O)c(c2)c1ccccn1)Cl

STK539463
Synonyms: methyl2- {4- [(butylcarbamoyl)amino]phenyl}- 3,3,3- trifluoro- 2- hydroxypropanoate
Smiles: CCCCNC(=O)Nc1ccc(cc1)C(C(F)(F)F)(C(=O)OC)O

STK539468
Synonyms: 2- amino- 4- {[2- (5- chlorothiophen- 2- yl)- 2- oxoethyl]sulfanyl}- 6- (methylsulfanyl)pyrimidine- 5- carbonitrile
Smiles: N#Cc1c(SCC(=O)c2ccc(s2)Cl)nc(nc1SC)N

STK539471
Synonyms: 6- [2- (4- bromophenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1c(OC)ccc(c1C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1ccc(cc1)Br

STK539473
Synonyms: methyl5- bromo- 3- {[(prop- 2- en- 1- yloxy)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1c(NC(=O)OCC=C)c2c([nH]1)ccc(c2)Br

STK539480
Synonyms: [2- (benzylsulfanyl)- 4- hydroxy- 6- methylpyrimidin- 5- yl]aceticacid
Smiles: OC(=O)Cc1c(C)nc(nc1O)SCc1ccccc1

STK539484
Synonyms: 8- ethyl- 2- (4- {[(4- methoxyphenyl)carbonyl]carbamothioyl}piperazin- 1- yl)- 5- oxo- 5,8- dihydropyrido[2,3- d]pyrimidine- 6- carboxylicacid
Smiles: COc1ccc(cc1)C(=O)NC(=S)N1CCN(CC1)c1ncc2c(n1)n(CC)cc(c2=O)C(=O)O

STK539487
Synonyms: ethyl6- bromo- 2- tert- butyl- 5- [(3- methylbut- 2- en- 1- yl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCC=C(C)C)c(cc2oc1C(C)(C)C)Br

STK840089
Synonyms: (2Z)- 3- [(4- chloro- 2,5- dimethoxyphenyl)amino]- 2- [4- (2- oxo- 2H- chromen- 3- yl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/Nc1cc(OC)c(cc1OC)Cl)/c1scc(n1)c1cc2ccccc2oc1=O

STK840091
Synonyms: ethyl5- (2- ethoxy- 2- oxo- 1- phenylethoxy)- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)C(c1ccccc1)Oc1ccc2c(c1)c(C(=O)OCC)c(o2)C

STK539495
Synonyms: N'- [(E)- furan- 2- ylmethylidene]- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1ccco1

STK539506
Synonyms: 2,3- dimethoxy- 6- [2- (thiophen- 2- yl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]benzoicacid
Smiles: COc1c(OC)ccc(c1C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1cccs1

STK840098
Synonyms: ethyl5- [(2,4- difluorobenzyl)oxy]- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1ccc(cc1F)F)cc2)c1ccc(cc1)OC

STK539516
Synonyms: N'- [(E)- (2,4- dimethoxyphenyl)methylidene]- 2- [4- (1H- tetrazol- 1- yl)phenoxy]acetohydrazide
Smiles: COc1cc(OC)ccc1/C=N/NC(=O)COc1ccc(cc1)n1cnnn1

STK539517
Synonyms: 8- {[2- (diethylamino)ethyl]amino}- 1,3- dimethyl- 7- (4- methylbenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCN(CCNc1nc2c(n1Cc1ccc(cc1)C)c(=O)n(c(=O)n2C)C)CC

STK840101
Synonyms: (2Z)- 3- amino- 3- (benzylamino)- 2- [(Z)- (3- oxo- 1,3- dihydro- 2H- indol- 2- ylidene)methyl]prop- 2- enenitrile
Smiles: N#C/C(=C(\NCc1ccccc1)/N)/C=C/1\Nc2c(C1=O)cccc2

STK840105
Synonyms: 7- ethyl- 3- methyl- 8- [(2- phenylethyl)amino]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(NCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK840106
Synonyms: 3- methyl- 7- pentyl- 8- (propylamino)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCn1c(NCCC)nc2c1c(=O)[nH]c(=O)n2C

STK539526
Synonyms: N'- [(E)- {2- [(4- bromobenzyl)oxy]phenyl}methylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1cncn1)N/N=C/c1ccccc1OCc1ccc(cc1)Br

STK840108
Synonyms: 8- (diethylamino)- 7- (4- fluorobenzyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCN(c1nc2c(n1Cc1ccc(cc1)F)c(=O)n(c(=O)n2C)C)CC

STK539538
Synonyms: N'- [(E)- (1,3- dimethyl- 1H- pyrazol- 4- yl)methylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/c1cn(nc1C)C

STK539540
Synonyms: 8- {[2- (dimethylamino)ethyl]amino}- 7- (4- fluorobenzyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CN(CCNc1nc2c(n1Cc1ccc(cc1)F)c(=O)n(c(=O)n2C)C)C

STK840115
Synonyms: 7- [3- (4- chlorophenoxy)- 2- hydroxypropyl]- 1,3- dimethyl- 8- (morpholin- 4- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Clc1ccc(cc1)OCC(Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCOCC1)O

STK840116
Synonyms: 3- methyl- 7- (3- methylbutyl)- 8- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(CCn1c(SCC(=C)C)nc2c1c(=O)[nH]c(=O)n2C)C

STK840118
Synonyms: 1,3- dimethyl- 7- pentyl- 8- (pyrrolidin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCC1

STK539547
Synonyms: N- [cyclopentyl(phenyl)methyl]- 7- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)heptanamide
Smiles: O=C(NC(c1ccccc1)C1CCCC1)CCCCCCN1C(=O)c2c(C1=O)cccc2

STK840119
Synonyms: ethyl6- bromo- 5- {[4- (methoxycarbonyl)benzyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OCc1ccc(cc1)C(=O)OC)c(c2)Br

STK539549
Synonyms: (2E)- 3- [(3- nitrophenyl)amino]- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)[N+](=O)[O-])/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK539551
Synonyms: 2,3- dimethoxy- 6- [2- (5- methylfuran- 2- yl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]benzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1ccc(o1)C

STK840121
Synonyms: ethyl2- tert- butyl- 5- (2- methoxy- 2- oxoethoxy)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCC(=O)OC)ccc2oc1C(C)(C)C

STK539560
Synonyms: 4- (furan- 2- yl)- 6- (piperidin- 1- yl)- 1,3,5- triazin- 2- amine
Smiles: Nc1nc(nc(n1)c1ccco1)N1CCCCC1

STK840126
Synonyms: 2- (1,3- benzothiazol- 2- ylamino)- 6- (methoxymethyl)pyrimidin- 4(1H)- one
Smiles: COCc1cc(=O)nc([nH]1)Nc1nc2c(s1)cccc2

STK539563
Synonyms: (6aR,6bS,9aR,10S)- 10- [(3,4- dimethoxyphenyl)carbonyl]- 8- 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)c1ccccc1)C=Cc1c2cccc1

STK840127
Synonyms: 1- ethyl- 4- hydroxy- N- (4- methylbenzyl)- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCn1c(=O)c(C(=O)NCc2ccc(cc2)C)c(c2c1cccc2)O

STK840129
Synonyms: ethyl6- bromo- 5- [(3- methoxybenzyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OCc1cccc(c1)OC)c(c2)Br

STK840132
Synonyms: 2- methoxyethyl6- bromo- 5- (cyanomethoxy)- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCC#N)c(c2)Br

STK539581
Synonyms: methyl4- {[3- cyano- 4- phenyl- 6- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- 3- oxobutanoate
Smiles: COC(=O)CC(=O)CSc1nc(cc(c1C#N)c1ccccc1)c1cccs1

STK840135
Synonyms: ethyl5- [(1- methoxy- 1- oxopropan- 2- yl)oxy]- 1,2- dimethyl- 1H- indole- 3- carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1cc(cc2)OC(C(=O)OC)C)C

STK539585
Synonyms: methyl5,6- dimethoxy- 3- {[(2- methylpiperidin- 1- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCCCC1C)cc(c(c2)OC)OC

STK539586
Synonyms: 2,3- dimethoxy- 6- (2- phenyl- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl)benzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1ccccc1

STK539587
Synonyms: (2E)- 4- (dimethylamino)- 4- methyl- 1,1- diphenylpent- 2- en- 1- ol
Smiles: CN(C(/C=C/C(c1ccccc1)(c1ccccc1)O)(C)C)C

STK840139
Synonyms: 7- (2- hydroxy- 3- phenoxypropyl)- 3- methyl- 8- sulfanyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(S)nc2c1c(=O)[nH]c(=O)n2C)COc1ccccc1

STK539592
Synonyms: 6- [2- (biphenyl- 4- yl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1ccc(cc1)c1ccccc1

STK539593
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (3- bromo- 4- hydroxy- 5- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cn2nnc(n2)N)cc(c1O)Br

STK539601
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- furan- 2- ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1ccco1

STK539603
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (2- methylphenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1ccccc1C

STK840141
Synonyms: 8- (benzylamino)- 7- (2,3- dihydroxypropyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCC(Cn1c(NCc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C)O

STK539608
Synonyms: (6aR,6bS,9aR,10S)- 8- (1,3- benzodioxol- 5- 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)OCO3)C(=O)[C@@H]2[C@H]1[C@H]1C=Cc3c(N1[C@@H]2C(=O)c1ccccc1)cccc3

STK539610
Synonyms: 2- {[2- amino- 5- cyano- 6- (methylsulfanyl)pyrimidin- 4- yl]sulfanyl}- N- (1- phenylethyl)acetamide
Smiles: N#Cc1c(SCC(=O)NC(c2ccccc2)C)nc(nc1SC)N

STK840143
Synonyms: (2E)- 3- (2,6- dichlorophenyl)- 1- (4- hydroxyphenyl)prop- 2- en- 1- one
Smiles: O=C(c1ccc(cc1)O)/C=C/c1c(Cl)cccc1Cl

STK539613
Synonyms: 3- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 7- [(pentafluorobenzyl)oxy]- 2H- chromen- 2- one
Smiles: Brc1ccc(cc1)c1csc(n1)c1cc2ccc(cc2oc1=O)OCc1c(F)c(F)c(c(c1F)F)F

STK539617
Synonyms: (2E)- 3- [(2- methoxyphenyl)amino]- 2- {4- [4- (2- methylpropyl)phenyl]- 1,3- thiazol- 2- yl}prop- 2- enenitrile
Smiles: N#C/C(=C\Nc1ccccc1OC)/c1scc(n1)c1ccc(cc1)CC(C)C

STK840144
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 2,8- dimethyl- 4- oxo- 4H- chromen- 7- ylpropanoate
Smiles: CCC(=O)Oc1ccc2c(c1C)oc(c(c2=O)c1nc2c(s1)cccc2)C

STK840146
Synonyms: 8- (cyclohexylamino)- 7- (2,3- dihydroxypropyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCC(Cn1c(NC2CCCCC2)nc2c1c(=O)n(c(=O)n2C)C)O

STK539625
Synonyms: 6- [9- bromo- 2- (4- methylphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)C1Oc2ccc(cc2C2N1N=C(C2)c1ccc(cc1)C)Br

STK539627
Synonyms: ethyl2- (4- methoxyphenyl)- 5- {[(3- nitrophenyl)carbonyl]oxy}- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(cc2)OC(=O)c1cccc(c1)[N+](=O)[O-])c1ccc(cc1)OC

STK840148
Synonyms: 7- ethyl- 8- (ethylamino)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCNc1nc2c(n1CC)c(=O)n(c(=O)n2C)C

STK840149
Synonyms: (1- cyclopentyl- 2,5- dimethyl- 1H- pyrrol- 3- yl)(morpholin- 4- yl)methanethione
Smiles: S=C(c1cc(n(c1C)C1CCCC1)C)N1CCOCC1

STK539634
Synonyms: 3,6- diamino- 5- cyano- N- (2,3- dimethoxybenzyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1c(cccc1OC)CNC(=O)c1sc2c(c1N)cc(c(n2)N)C#N

STK539638
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- furan- 2- ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1ccco1

STK539639
Synonyms: N- ({2- [(4- propoxyphenyl)carbonyl]hydrazinyl}carbonothioyl)furan- 2- carboxamide
Smiles: CCCOc1ccc(cc1)C(=O)NNC(=S)NC(=O)c1ccco1

STK840164
Synonyms: N- {[1- (3,4- dimethoxyphenyl)cyclopentyl]methyl}- 3- (2- hydroxyphenyl)- 3- phenylpropanamide
Smiles: COc1cc(ccc1OC)C1(CCCC1)CNC(=O)CC(c1ccccc1O)c1ccccc1

STK840166
Synonyms: 3- (pyridin- 2- yl)- 7- {[2- (trifluoromethyl)benzyl]oxy}- 2H- chromen- 2- one
Smiles: O=c1oc2cc(OCc3ccccc3C(F)(F)F)ccc2cc1c1ccccn1

STK840169
Synonyms: 2- {1- [4- (dimethylamino)phenyl]- 3- (4- methoxybenzyl)- 5- oxo- 2- thioxoimidazolidin- 4- yl}- N- (4- ethylphenyl)acetamide
Smiles: CCc1ccc(cc1)NC(=O)CC1C(=O)N(C(=S)N1Cc1ccc(cc1)OC)c1ccc(cc1)N(C)C

STK840171
Synonyms: ethyl5- (2- ethoxy- 2- oxoethoxy)- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCC(=O)OCC)cc2)c1ccc(cc1)OC

STK539662
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- {(E)- [4- (propan- 2- yl)phenyl]methylidene}acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1ccc(cc1)C(C)C

STK539663
Synonyms: 6- [2- (3,4- dichlorophenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1c(OC)ccc(c1C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1ccc(c(c1)Cl)Cl

STK539665
Synonyms: 1- ethyl- 6- fluoro- 4- oxo- 7- [4- (phenoxyacetyl)piperazin- 1- yl]- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=O)COc1ccccc1)c(c2)F

STK539667
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 2,8- dimethyl- 4- oxo- 4H- chromen- 7- yl3- cyclopentylpropanoate
Smiles: O=C(Oc1ccc2c(c1C)oc(c(c2=O)c1nc2c(s1)cccc2)C)CCC1CCCC1

STK539668
Synonyms: ethyl6- bromo- 5- [(3- bromobenzyl)oxy]- 2- tert- butyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCc3cccc(c3)Br)c(cc2oc1C(C)(C)C)Br

STK539671
Synonyms: N- (5- bromo- 2- oxo- 2,3- dihydro- 1H- indol- 3- yl)- 2,2,2- trifluoroacetamide
Smiles: O=C(C(F)(F)F)NC1C(=O)Nc2c1cc(Br)cc2

STK539675
Synonyms: 7- ethyl- 1,3- dimethyl- 8- [(2E)- 2- (pyridin- 3- ylmethylidene)hydrazinyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(N/N=C/c2cccnc2)nc2c1c(=O)n(c(=O)n2C)C

STK840181
Synonyms: 7- (2,3- dichlorophenyl)- 3- phenyl- 4H,6H- pyrrolo[3',4':4,5][1,3]thiazolo[2,3- c][1,2,4]triazine- 4,6,8(7H)- trione
Smiles: Clc1cccc(c1Cl)n1c(=O)c2c(c1=O)sc1n2c(=O)c(nn1)c1ccccc1

STK840182
Synonyms: 8- (cyclohexylamino)- 1,3- dimethyl- 7- (propan- 2- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc(n2C(C)C)NC1CCCCC1

STK840184
Synonyms: 8- [benzyl(methyl)amino]- 7- (4- fluorobenzyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccc(cc1)Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N(Cc1ccccc1)C

STK539679
Synonyms: ethyl5- [(2,6- dichlorobenzyl)oxy]- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1c(Cl)cccc1Cl)cc2)c1ccc(cc1)OC

STK539685
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 8- methyl- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- yl2- methylbenzoate
Smiles: O=C(c1ccccc1C)Oc1ccc2c(c1C)oc(c(c2=O)c1nc2c(s1)cccc2)C(F)(F)F

STK840187
Synonyms: propan- 2- yl5- {[(4- fluorophenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CC(OC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1ccc(cc1)F)C

STK539692
Synonyms: N'- [(E)- (3- methoxyphenyl)methylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: COc1cccc(c1)/C=N/NC(=O)Cn1cncn1

STK840189
Synonyms: 4,6- dimethyl- 2- [(1- methyl- 4- nitro- 1H- imidazol- 5- yl)sulfanyl]pyridine- 3- carbonitrile
Smiles: N#Cc1c(C)cc(nc1Sc1n(C)cnc1[N+](=O)[O-])C

STK539697
Synonyms: 3- chloro- N- (4- chloro- 2- {[(2- hydrazinyl- 2- oxoethyl)amino](phenyl)methyl}phenyl)benzamide(non- preferredname)
Smiles: NNC(=O)CNC(c1cc(Cl)ccc1NC(=O)c1cccc(c1)Cl)c1ccccc1

STK539704
Synonyms: 4- hydroxy- 2- oxo- N- [2- (piperazin- 1- yl)ethyl]- 1,2- dihydroquinoline- 3- carboxamide
Smiles: O=C(c1c(=O)[nH]c2c(c1O)cccc2)NCCN1CCNCC1

STK840198
Synonyms: [1- (2- chlorobenzyl)- 1H- indol- 3- yl](morpholin- 4- yl)methanethione
Smiles: Clc1ccccc1Cn1cc(c2c1cccc2)C(=S)N1CCOCC1

STK840203
Synonyms: ethyl6- bromo- 5- {[(3- methoxyphenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OC(=O)c1cccc(c1)OC)c(c2)Br

STK539720
Synonyms: 2- [(2,2- dicyano- 1- {[3- (trifluoromethyl)phenyl]amino}ethenyl)sulfanyl]- N,N- diethylacetamide
Smiles: CCN(C(=O)CSC(=C(C#N)C#N)Nc1cccc(c1)C(F)(F)F)CC

STK840206
Synonyms: [3- amino- 6- methyl- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydrothieno[2,3- b][1,6]naphthyridin- 2- yl](1,3- benzodioxol- 5- yl)methanone
Smiles: CN1CCc2c(C1)c(c1cccs1)c1c(n2)sc(c1N)C(=O)c1ccc2c(c1)OCO2

STK539723
Synonyms: 7- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- N- [(4- methylphenyl)(phenyl)methyl]heptanamide
Smiles: Cc1ccc(cc1)C(c1ccccc1)NC(=O)CCCCCCN1C(=O)c2c(C1=O)cccc2

STK840207
Synonyms: 9- [2- (prop- 2- en- 1- yloxy)ethyl]- 9H- carbazole
Smiles: C=CCOCCn1c2ccccc2c2c1cccc2

STK539735
Synonyms: N- (3- acetylphenyl)- 2,2- difluoro- 2- (2,3,3,4,4,5,5- heptafluorotetrahydrofuran- 2- yl)acetamide
Smiles: CC(=O)c1cccc(c1)NC(=O)C(C1(F)OC(C(C1(F)F)(F)F)(F)F)(F)F

STK840210
Synonyms: 2- [4- (4- fluorophenyl)piperazin- 1- yl]- 4,6- dimethylpyridine- 3- carbonitrile
Smiles: N#Cc1c(C)cc(nc1N1CCN(CC1)c1ccc(cc1)F)C

STK539739
Synonyms: 6- amino- 1- methyl- 3- propyl- 4- (pyridin- 4- yl)- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: CCCc1nn(c2c1C(c1ccncc1)C(=C(O2)N)C#N)C

STK539742
Synonyms: 3- amino- N- [2- (3,4- dimethoxyphenyl)ethyl]- 6- (3- methoxyphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)NCCc1ccc(c(c1)OC)OC

STK840212
Synonyms: 4- hydroxy- N- (4- methylbenzyl)- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: Cc1ccc(cc1)CNC(=O)c1c(=O)[nH]c2c(c1O)cccc2

STK539749
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (2- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)Cn1nnc(n1)N

STK840215
Synonyms: ethyl2- (4- methoxyphenyl)- 5- {[2- (trifluoromethyl)benzyl]oxy}- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1ccccc1C(F)(F)F)cc2)c1ccc(cc1)OC

STK840217
Synonyms: 2- (tetrahydrofuran- 2- ylmethyl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: O=c1c2cccc3c2c(c(=O)n1CC1CCCO1)ccc3

STK840219
Synonyms: N'- [(E)- (3,5- dibromo- 2- hydroxyphenyl)methylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/c1cc(Br)cc(c1O)Br

STK539761
Synonyms: {[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}aceticacid
Smiles: COc1ccc(cc1)n1c(SCC(=O)O)nc2c(c1=O)c1CC(OCc1s2)C(C)C

STK539768
Synonyms: prop- 2- en- 1- ylN'- [(E)- (3- bromo- 2- hydroxy- 5- nitrophenyl)methylidene]carbamohydrazonothioate
Smiles: C=CCS/C(=N\N=C\c1cc(cc(c1O)Br)[N+](=O)[O-])/N

STK539773
Synonyms: N'- [(1E)- 1- (4- methylphenyl)ethylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: C/C(=N\NC(=O)Cn1ncnc1)/c1ccc(cc1)C

STK539776
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (2,4- dimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(OC)ccc1/C=N/NC(=O)Cn1nnc(n1)N

STK840223
Synonyms: methyl2- methyl- 5- [(phenylcarbonyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: COC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1ccccc1

STK539786
Synonyms: 3- {[(E)- (3,4- dihydroxyphenyl)methylidene]amino}- 2- propylquinazolin- 4(3H)- one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1ccc(c(c1)O)O

STK840226
Synonyms: 8- (dimethylamino)- 7- [2- hydroxy- 3- (4- methoxyphenoxy)propyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1ccc(cc1)OCC(Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N(C)C)O

STK539790
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(2E)- 1- phenylbutan- 2- ylidene]acetohydrazide
Smiles: CC/C(=N\NC(=O)Cn1nnc(n1)N)/Cc1ccccc1

STK840228
Synonyms: 2- (pyridin- 2- ylsulfanyl)- N'- [(E)- thiophen- 2- ylmethylidene]acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/c1cccs1

STK840229
Synonyms: 2- ({[(2- iodophenyl)carbonyl]carbamothioyl}amino)- 6- methyl- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxamide
Smiles: CC1CCc2c(C1)sc(c2C(=O)N)NC(=S)NC(=O)c1ccccc1I

STK539792
Synonyms: 2- {[2- (3- methoxyphenyl)quinazolin- 4- yl]amino}ethanol
Smiles: OCCNc1nc(nc2c1cccc2)c1cccc(c1)OC

STK840231
Synonyms: 2- (6- methoxy- 2- methyl- 4- oxoquinolin- 1(4H)- yl)- N- (2- methoxyphenyl)acetamide
Smiles: COc1ccc2c(c1)c(=O)cc(n2CC(=O)Nc1ccccc1OC)C

STK539798
Synonyms: methyl5- bromo- 3- [(thiophen- 2- ylcarbonyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1cccs1)cc(cc2)Br

STK539802
Synonyms: 3- ethoxy- 2- (4- fluorophenyl)- 5- phenyl- 2,3- dihydro- 1,3- oxaphosphole3- oxide
Smiles: CCOP1(=O)C=C(OC1c1ccc(cc1)F)c1ccccc1

STK840236
Synonyms: 8- {(2E)- 2- [4- (dimethylamino)benzylidene]hydrazinyl}- 7- [2- hydroxy- 3- (propan- 2- yloxy)propyl]- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(N/N=C/c2ccc(cc2)N(C)C)nc2c1c(=O)[nH]c(=O)n2C)COC(C)C

STK539806
Synonyms: ethyl5- {2- [(2E)- 2- (2- methoxybenzylidene)hydrazinyl]- 2- oxoethoxy}- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCC(=O)N/N=C/c1ccccc1OC)cc2)c1ccccc1

STK840242
Synonyms: 1- (ethylsulfanyl)- 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: CCSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CCCC3

STK539814
Synonyms: 8- (propan- 2- yloxy)- 5- propyl- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncnc3OC(C)C

STK539818
Synonyms: methylN'- [(E)- (3- bromo- 2- hydroxy- 5- nitrophenyl)methylidene]carbamohydrazonothioate
Smiles: CS/C(=N\N=C\c1cc(cc(c1O)Br)[N+](=O)[O-])/N

STK840245
Synonyms: ethyl{[3- (3- methylbenzyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2ccccc2c(=O)n1Cc1cccc(c1)C

STK539819
Synonyms: ethyl6- bromo- 5- [(3- bromobenzyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OCc1cccc(c1)Br)c(c2)Br

STK539829
Synonyms: 4,6- dimethyl- 2- {(2E)- 2- [(3E)- 4- phenylbut- 3- en- 2- ylidene]hydrazinyl}pyrimidine
Smiles: C/C(=N\Nc1nc(C)cc(n1)C)/C=C/c1ccccc1

STK539831
Synonyms: methyl3- [(phenoxycarbonyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)Oc1ccccc1)cccc2

STK539833
Synonyms: 1- heptyl- 2- hydroxy- 4- imino- 1,4- dihydroquinoline- 3- carbohydrazide
Smiles: CCCCCCCn1c(O)c(C(=O)NN)c(=N)c2c1cccc2

STK840249
Synonyms: ethyl2- tert- butyl- 5- [(4- fluorobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCc3ccc(cc3)F)ccc2oc1C(C)(C)C

STK539834
Synonyms: N'- [(E)- (3- methoxy- 4- propoxyphenyl)methylidene]- 2- methylquinoline- 4- carbohydrazide
Smiles: CCCOc1ccc(cc1OC)/C=N/NC(=O)c1cc(C)nc2c1cccc2

STK539835
Synonyms: ethyl6,7- difluoro- 4- oxo- 1- propyl- 1,4- dihydroquinoline- 3- carboxylate
Smiles: CCCn1cc(C(=O)OCC)c(=O)c2c1cc(F)c(c2)F

STK840250
Synonyms: 8- (diethylamino)- 1,3- dimethyl- 7- (propan- 2- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCN(c1nc2c(n1C(C)C)c(=O)n(c(=O)n2C)C)CC

STK539842
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- [(1,3- dioxolan- 2- ylmethyl)(methyl)amino]ethanone
Smiles: CN(CC(=O)c1c(C)[nH]c2c1ccc(c2)C)CC1OCCO1

STK539848
Synonyms: ethyl5- {[(2- bromophenyl)carbonyl]oxy}- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(cc2)OC(=O)c1ccccc1Br)c1ccc(cc1)OC

STK840255
Synonyms: 1,3- dimethyl- 7- (3- methylbenzyl)- 8- (propylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCSc1nc2c(n1Cc1cccc(c1)C)c(=O)n(c(=O)n2C)C

STK539851
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (2- hydroxy- 3- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cccc(c1O)/C=N/NC(=O)Cn1nnc(n1)N

STK539854
Synonyms: 8- (dimethylamino)- 1,3- dimethyl- 7- (2- phenylethyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CN(c1nc2c(n1CCc1ccccc1)c(=O)n(c(=O)n2C)C)C

STK539855
Synonyms: 2- amino- N- cyclohexyl- 1- (3,5- dimethylphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Cc1cc(C)cc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NC1CCCCC1

STK539856
Synonyms: 3- [(3,5- dichloropyridin- 2- yl)amino]- 2- (4- methoxyphenyl)- 1,3- thiazolidin- 4- one
Smiles: COc1ccc(cc1)C1SCC(=O)N1Nc1ncc(cc1Cl)Cl

STK539860
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- [4- (2- hydroxyethyl)piperazin- 1- yl]ethanone
Smiles: OCCN1CCN(CC1)CC(=O)c1c(C)[nH]c2c1ccc(c2)C

STK539869
Synonyms: 3,3'- (1H- imidazole- 1,4- diyl)dipropanoicacid
Smiles: OC(=O)CCn1cnc(c1)CCC(=O)O

STK840257
Synonyms: ethyl6- bromo- 2- methyl- 5- [(3- methylbut- 2- en- 1- yl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OCC=C(C)C)c(c2)Br

STK840260
Synonyms: ethyl6- bromo- 5- {[(4- methoxyphenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OC(=O)c1ccc(cc1)OC)c(c2)Br

STK539875
Synonyms: 7,8- dichloro- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: OC(=O)c1c[nH]c2c(c1=O)ccc(c2Cl)Cl

STK539876
Synonyms: 5- [(2- chloro- 4- fluorobenzyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylicacid
Smiles: Fc1ccc(c(c1)Cl)COc1ccc2c(c1)c(C(=O)O)c(o2)C

STK539877
Synonyms: (3Z)- 3- {2- [4- (2- methylpropyl)phenyl]- 2- oxoethylidene}- 1,3- dihydro- 2H- indol- 2- one
Smiles: CC(Cc1ccc(cc1)C(=O)/C=C/1\C(=O)Nc2c1cccc2)C

STK840264
Synonyms: 2- methoxyethyl6- bromo- 5- [(1- ethoxy- 1- oxopropan- 2- yl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OC(C(=O)OCC)C)c(c2)Br

STK840268
Synonyms: 2- (2- {4- [(2,4- dichlorophenoxy)acetyl]piperazin- 1- yl}ethyl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: Clc1ccc(c(c1)Cl)OCC(=O)N1CCN(CC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK539892
Synonyms: methyl3- {[(4- cyclohexylpiperazin- 1- yl)acetyl]amino}- 5,6- dimethoxy- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C1CCCCC1)cc(c(c2)OC)OC

STK840271
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 8- methyl- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- ylacetate
Smiles: CC(=O)Oc1ccc2c(c1C)oc(c(c2=O)c1nc2c(s1)cccc2)C(F)(F)F

STK840272
Synonyms: 2- methoxyethyl5- (2- hydrazinyl- 2- oxoethoxy)- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCC(=O)NN)cc2

STK840273
Synonyms: (2Z)- 3- (2- bromophenyl)- 2- [4- (2,4- dichlorophenyl)- 1,3- thiazol- 2- yl]prop- 2- enenitrile
Smiles: N#C/C(=C/c1ccccc1Br)/c1scc(n1)c1ccc(cc1Cl)Cl

STK539897
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (1,3- dimethyl- 1H- pyrazol- 4- yl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1cn(nc1C)C

STK539905
Synonyms: ethyl5- {[(4- bromophenyl)carbonyl]oxy}- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(cc2)OC(=O)c1ccc(cc1)Br)c1ccc(cc1)OC

STK840279
Synonyms: (2E)- 2- cyano- N- cyclohexyl- 3- (1- {2- [(furan- 2- ylmethyl)amino]- 2- oxoethyl}- 1H- indol- 3- yl)prop- 2- enamide
Smiles: N#C/C(=C\c1cn(c2c1cccc2)CC(=O)NCc1ccco1)/C(=O)NC1CCCCC1

STK539908
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(Z)- (4- hydroxy- 3- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N\NC(=O)Cn2nnc(n2)N)ccc1O

STK539913
Synonyms: 3- [benzyl(hydroxy)phosphoryl]propanoicacid
Smiles: OC(=O)CCP(=O)(Cc1ccccc1)O

STK539916
Synonyms: 2- {[(5- hydroxy- 1H- pyrazol- 3- yl)methyl]sulfanyl}- 4,6- dimethylpyridine- 3- carbonitrile
Smiles: N#Cc1c(C)cc(nc1SCc1n[nH]c(c1)O)C

STK539920
Synonyms: 6'- amino- 3'- methyl- 2,3,5,6- tetrahydro- 2'H- spiro[pyran- 4,4'- pyrano[2,3- c]pyrazole]- 5'- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31CCOCC3)c(C)[nH]n2

STK539927
Synonyms: ethyl1- amino- 8,8- dimethyl- 5- (pyrrolidin- 1- yl)- 8,9- dihydro- 6H- pyrano[4,3- d]thieno[2,3- b]pyridine- 2- carboxylate
Smiles: CCOC(=O)c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCCC1

STK539928
Synonyms: (2E)- N- (4- ethoxybenzyl)- 2- (pyridin- 3- ylmethylidene)hydrazinecarbothioamide
Smiles: CCOc1ccc(cc1)CNC(=S)N/N=C/c1cccnc1

STK840286
Synonyms: 2- {2- [4- (naphthalen- 2- ylsulfonyl)piperazin- 1- yl]ethyl}- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: O=c1n(CCN2CCN(CC2)S(=O)(=O)c2ccc3c(c2)cccc3)c(=O)c2c3c1cccc3ccc2

STK840287
Synonyms: 3- (ethylsulfanyl)- 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: CCSc1nnc2n1c(SC)nc1c2c2CC(OCc2s1)C(C)C

STK539938
Synonyms: N'- [(2E,3E)- 4- phenylbut- 3- en- 2- ylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1cncn1)N/N=C(/C=C/c1ccccc1)\C

STK539939
Synonyms: (9E)- 9- (4- fluorobenzylidene)- 3,5- bis(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)F)/C(=C/c1ccc(cc1)F)/CCC2

STK539940
Synonyms: N'- {(E)- [4- (dimethylamino)phenyl]methylidene}- 2- (morpholin- 4- yl)- 2- (pyridin- 4- yl)acetohydrazide
Smiles: CN(c1ccc(cc1)/C=N/NC(=O)C(c1ccncc1)N1CCOCC1)C

STK539946
Synonyms: N'- [(E)- (4- ethoxy- 3- hydroxyphenyl)methylidene]- 2- methylquinoline- 4- carbohydrazide
Smiles: CCOc1ccc(cc1O)/C=N/NC(=O)c1cc(C)nc2c1cccc2

STK840293
Synonyms: N- {[2- (phenylcarbonyl)hydrazinyl]carbonothioyl}pyridine- 3- carboxamide
Smiles: S=C(NC(=O)c1cccnc1)NNC(=O)c1ccccc1

STK840295
Synonyms: 8- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 7- ethyl- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(SCC(=O)c2ccc(cc2)Cl)nc2c1c(=O)n(c(=O)n2C)C

STK539953
Synonyms: N'- [(E)- (5- methylfuran- 2- yl)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(o1)C

STK539958
Synonyms: N'- [(E)- (3- methoxy- 4- propoxyphenyl)methylidene]- 2- phenylquinoline- 4- carbohydrazide
Smiles: CCCOc1ccc(cc1OC)/C=N/NC(=O)c1cc(nc2c1cccc2)c1ccccc1

STK539960
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 3- bromo- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: O=C(c1coc(=O)c(c1)Br)NCc1ccc2c(c1)OCO2

STK539961
Synonyms: 1- (4- chlorophenyl)- 3- (1- hydroxynaphthalen- 2- yl)propane- 1,3- dione
Smiles: Clc1ccc(cc1)C(=O)CC(=O)c1ccc2c(c1O)cccc2

STK539964
Synonyms: (2E)- 3- [4- (dimethylamino)phenyl]- 1- (1- hydroxynaphthalen- 2- yl)prop- 2- en- 1- one
Smiles: CN(c1ccc(cc1)/C=C/C(=O)c1ccc2c(c1O)cccc2)C

STK539973
Synonyms: ethyl3- ({[(2E)- 3- (furan- 2- yl)prop- 2- enoyl]carbamothioyl}amino)benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=S)NC(=O)/C=C/c1ccco1

STK539975
Synonyms: 9- [(4- methyl- 1,3- dioxolan- 2- yl)methyl]- 9H- carbazole
Smiles: CC1COC(O1)Cn1c2ccccc2c2c1cccc2

STK539976
Synonyms: 7- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- N- [1- (5,6,7,8- tetrahydronaphthalen- 2- yl)ethyl]heptanamide
Smiles: O=C(NC(c1ccc2c(c1)CCCC2)C)CCCCCCN1C(=O)c2c(C1=O)cccc2

STK539983
Synonyms: 2,5- bis[(tert- butylamino)methyl]- 1,6- bis(4- methoxyphenyl)hexane- 1,6- dione
Smiles: COc1ccc(cc1)C(=O)C(CNC(C)(C)C)CCC(C(=O)c1ccc(cc1)OC)CNC(C)(C)C

STK539984
Synonyms: 2- cyclopropyl- N'- [(E)- (2,4- dihydroxyphenyl)methylidene]quinoline- 4- carbohydrazide
Smiles: Oc1ccc(c(c1)O)/C=N/NC(=O)c1cc(nc2c1cccc2)C1CC1

STK539988
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(1E)- 1- phenylpropylidene]acetohydrazide
Smiles: CC/C(=N\NC(=O)Cn1nnc(n1)N)/c1ccccc1

STK539993
Synonyms: 2,5- bis[(tert- butylamino)methyl]- 1,6- bis[4- (pentyloxy)phenyl]hexane- 1,6- dione
Smiles: CCCCCOc1ccc(cc1)C(=O)C(CNC(C)(C)C)CCC(C(=O)c1ccc(cc1)OCCCCC)CNC(C)(C)C

STK540001
Synonyms: (2E)- N- {[2- (phenylsulfonyl)hydrazinyl]carbonothioyl}- 3- (thiophen- 2- yl)prop- 2- enamide
Smiles: S=C(NC(=O)/C=C/c1cccs1)NNS(=O)(=O)c1ccccc1

STK540003
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(1E)- 1- (4- methylphenyl)ethylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C(/c1ccc(cc1)C)\C

STK540006
Synonyms: 9- [(4- ethyl- 1,3- dioxolan- 2- yl)methyl]- 9H- carbazole
Smiles: CCC1COC(O1)Cn1c2ccccc2c2c1cccc2

STK840306
Synonyms: ethyl2- tert- butyl- 5- [2- oxo- 2- (propan- 2- yloxy)ethoxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCC(=O)OC(C)C)ccc2oc1C(C)(C)C

STK840307
Synonyms: 1- [6- hydroxy- 3,6- dimethyl- 4- (4- methylphenyl)- 4,5,6,7- tetrahydro- 2,1- benzoxazol- 5- yl]ethanone
Smiles: Cc1ccc(cc1)C1c2c(C)onc2CC(C1C(=O)C)(C)O

STK540010
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (3- hydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1cccc(c1)O

STK540011
Synonyms: 2- (3,4- dimethoxyphenyl)- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1cc(ccc1OC)c1nn2c(n1)c1c(nc2)sc2c1CCC2

STK540012
Synonyms: 2,4- bis[(4- methylpiperidin- 1- yl)methyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CC1CCN(CC1)Cn1ncn(c1=S)CN1CCC(CC1)C

STK840309
Synonyms: ethyl2- tert- butyl- 5- [(2- chlorobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCc3ccccc3Cl)ccc2oc1C(C)(C)C

STK840310
Synonyms: 2,2- diphenyl- N- [(4- phenyltetrahydro- 2H- pyran- 4- yl)methyl]acetamide
Smiles: O=C(C(c1ccccc1)c1ccccc1)NCC1(CCOCC1)c1ccccc1

STK540015
Synonyms: 1- ethyl- 6- fluoro- 4- oxo- 7- {4- [(3,4,5- trimethoxyphenyl)carbonyl]piperazin- 1- yl}- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: COc1cc(cc(c1OC)OC)C(=O)N1CCN(CC1)c1cc2n(CC)cc(c(=O)c2cc1F)C(=O)O

STK840313
Synonyms: ethyl2- tert- butyl- 5- (cyanomethoxy)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCC#N)ccc2oc1C(C)(C)C

STK840316
Synonyms: (2E)- 3- (4- fluorophenyl)- N- [4- (morpholin- 4- yl)phenyl]prop- 2- enamide
Smiles: O=C(Nc1ccc(cc1)N1CCOCC1)/C=C/c1ccc(cc1)F

STK540032
Synonyms: 7- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- N- [(4- methoxyphenyl)(phenyl)methyl]heptanamide
Smiles: COc1ccc(cc1)C(c1ccccc1)NC(=O)CCCCCCN1C(=O)c2c(C1=O)cccc2

STK540035
Synonyms: (2Z,4E)- 5- (4- nitrophenyl)- 2- [4- (3- nitrophenyl)- 1,3- thiazol- 2- yl]penta- 2,4- dienenitrile
Smiles: N#C/C(=C/C=C/c1ccc(cc1)[N+](=O)[O-])/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK540038
Synonyms: 2- methoxyethyl6- bromo- 5- [(3,4- dichlorobenzyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCc1ccc(c(c1)Cl)Cl)c(c2)Br

STK840327
Synonyms: 8- (diethylamino)- 7- ethyl- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCN(c1nc2c(n1CC)c(=O)n(c(=O)n2C)C)CC

STK540046
Synonyms: ethyl5- [(3,4- dichlorobenzyl)oxy]- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1ccc(c(c1)Cl)Cl)cc2)c1ccc(cc1)OC

STK840329
Synonyms: propan- 2- yl2- methyl- 5- [(3- nitrobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CC(OC(=O)c1c(C)oc2c1cc(OCc1cccc(c1)[N+](=O)[O-])cc2)C

STK840332
Synonyms: 3- methyl- 7- (2- phenylethyl)- 8- (pyrrolidin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=c1[nH]c(=O)n(c2c1n(CCc1ccccc1)c(n2)N1CCCC1)C

STK540047
Synonyms: N'- [(E)- {2- [(4- chlorobenzyl)oxy]phenyl}methylidene]- 2- [4- (1H- tetrazol- 1- yl)phenoxy]acetohydrazide
Smiles: O=C(COc1ccc(cc1)n1cnnn1)N/N=C/c1ccccc1OCc1ccc(cc1)Cl

STK840333
Synonyms: ethyl5- ethoxy- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCC)cc2)c1ccc(cc1)OC

STK540050
Synonyms: methyl5- bromo- 3- {[(3- methoxyphenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COc1cccc(c1)C(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OC

STK840335
Synonyms: 3- methyl- 7- (3- methylbutyl)- 8- (propylamino)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCNc1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C

STK840336
Synonyms: propan- 2- yl2- methyl- 5- {[(3- nitrophenyl)carbonyl]oxy}- 1- benzofuran- 3- carboxylate
Smiles: CC(OC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1cccc(c1)[N+](=O)[O-])C

STK540057
Synonyms: 4- [4- (3- chlorophenyl)piperazin- 1- yl]- 8- methoxy- 5H- pyrimido[5,4- b]indole
Smiles: COc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)c1cccc(c1)Cl

STK840337
Synonyms: ethyl5- [(2- fluorobenzyl)oxy]- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1ccccc1F)cc2)c1ccc(cc1)OC

STK840338
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(E)- (4- fluorophenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnnc1N)N/N=C/c1ccc(cc1)F

STK840344
Synonyms: N- acetyl- N- (4- cyano- 5H- pyrido[4,3- b]indol- 3- yl)acetamide
Smiles: N#Cc1c(ncc2c1[nH]c1c2cccc1)N(C(=O)C)C(=O)C

STK840351
Synonyms: ethyl2- (4- methoxyphenyl)- 5- [(4- methylbenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1ccc(cc1)C)cc2)c1ccc(cc1)OC

STK540072
Synonyms: 2- (5- bromo- 2,4- dimethoxyphenyl)- 4,5- diphenyl- 1H- imidazole
Smiles: COc1cc(OC)c(cc1c1nc(c([nH]1)c1ccccc1)c1ccccc1)Br

STK840352
Synonyms: ethyl2- tert- butyl- 5- [(3,4- dichlorobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCc3ccc(c(c3)Cl)Cl)ccc2oc1C(C)(C)C

STK540074
Synonyms: N- [3- (acetylamino)phenyl]- 2- {[3- cyano- 6- methyl- 4- (trifluoromethyl)pyridin- 2- yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)Nc2cccc(c2)NC(=O)C)nc(cc1C(F)(F)F)C

STK540081
Synonyms: 2- (1,3- benzothiazol- 2- ylsulfanyl)- N'- [(E)- (1- ethyl- 3,5- dimethyl- 1H- pyrazol- 4- yl)methylidene]acetohydrazide
Smiles: CCn1nc(c(c1C)/C=N/NC(=O)CSc1nc2c(s1)cccc2)C

STK540083
Synonyms: 3- (ethylsulfanyl)- 9- methyl- 5- (methylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCSc1nnc2n1c(SC)nc1c2c2CCC(Cc2s1)C

STK540096
Synonyms: 11- (2- methylpropyl)- 3- [2- (morpholin- 4- yl)ethyl]- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CC(Cn1c2ncn(c(=O)c2c2c1nc1ccccc1n2)CCN1CCOCC1)C

STK540099
Synonyms: N'- [(1E)- 1- phenylbutylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: CCC/C(=N\NC(=O)Cn1cncn1)/c1ccccc1

STK840361
Synonyms: (2E)- 3- phenyl- N- {[2- (thiophen- 2- ylacetyl)hydrazinyl]carbonothioyl}prop- 2- enamide
Smiles: O=C(Cc1cccs1)NNC(=S)NC(=O)/C=C/c1ccccc1

STK840363
Synonyms: 2- methoxyethyl6- bromo- 5- ethoxy- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCC)c(c2)Br

STK840364
Synonyms: 2- ({[(2- iodophenyl)carbonyl]carbamothioyl}amino)- 4,5,6,7,8,9- hexahydrocycloocta[b]thiophene- 3- carboxamide
Smiles: S=C(NC(=O)c1ccccc1I)Nc1sc2c(c1C(=O)N)CCCCCC2

STK840368
Synonyms: 10,11- dihydro- 5H- dibenzo[b,f]azepin- 5- yl(morpholin- 4- yl)methanone
Smiles: O=C(N1c2ccccc2CCc2c1cccc2)N1CCOCC1

STK840369
Synonyms: methyl2- methyl- 5- {[(pentafluorophenoxy)acetyl]oxy}- 1- benzofuran- 3- carboxylate
Smiles: COC(=O)c1c(C)oc2c1cc(cc2)OC(=O)COc1c(F)c(F)c(c(c1F)F)F

STK540115
Synonyms: ethyl6- bromo- 5- (2- ethoxy- 2- oxo- 1- phenylethoxy)- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)C(c1ccccc1)Oc1cc2c(cc1Br)oc(c2C(=O)OCC)c1ccccc1

STK840371
Synonyms: 2- methoxyethyl5- [(2- chloro- 4- fluorobenzyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCc1ccc(cc1Cl)F)cc2

STK540116
Synonyms: methyl3- [(3- cyclopentylpropanoyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCC1CCCC1)cccc2

STK540122
Synonyms: 3- {4- [(5E)- 5- benzylidene- 4- oxo- 4,5- dihydro- 1,3- thiazol- 2- yl]piperazin- 1- yl}propanenitrile
Smiles: N#CCCN1CCN(CC1)C1=NC(=O)/C(=C\c2ccccc2)/S1

STK540123
Synonyms: 2- imino- 1- (4- methoxybenzyl)- 5- oxo- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carbonitrile
Smiles: N#Cc1cc2c(n(c1=N)Cc1ccc(cc1)OC)nc1n(c2=O)cccc1

STK540124
Synonyms: 6- [9- bromo- 2- (4- bromophenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)C1Oc2ccc(cc2C2N1N=C(C2)c1ccc(cc1)Br)Br

STK540125
Synonyms: N- (4- methoxyphenyl)- 2- (2- methyl- 4- oxoquinolin- 1(4H)- yl)acetamide
Smiles: COc1ccc(cc1)NC(=O)Cn1c(C)cc(=O)c2c1cccc2

STK540130
Synonyms: 4- ethoxy- N- [(1R,2S)- 1- hydroxy- 1- phenylpropan- 2- yl]- 3- (1- methyl- 7- oxo- 3- propyl- 6,7- dihydro- 1H- pyrazolo[4,3- d]pyrimidin- 5- yl)benzenesulfonamide
Smiles: CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)N[C@H]([C@@H](c1ccccc1)O)C)C

STK540135
Synonyms: 3,6- diamino- N- [4- (butan- 2- yl)phenyl]- 5- cyanothieno[2,3- b]pyridine- 2- carboxamide
Smiles: CCC(c1ccc(cc1)NC(=O)c1sc2c(c1N)cc(c(n2)N)C#N)C

STK540139
Synonyms: (2Z)- 2- (1,3- benzothiazol- 2- yl)- 3- hydroxy- 4- (pentafluorophenoxy)but- 2- enenitrile
Smiles: N#C/C(=C(\COc1c(F)c(F)c(c(c1F)F)F)/O)/c1nc2c(s1)cccc2

STK540142
Synonyms: N'- [(E)- (2- methoxyphenyl)methylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)Cn1cncn1

STK840378
Synonyms: 2- methoxyethyl6- bromo- 5- [(2- bromobenzyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCc1ccccc1Br)c(c2)Br

STK540147
Synonyms: (1R,9R)- 2,5,8- trimethyl- 1,9- di(pyridin- 3- yl)- 2,3,4,5,6,7,8,9- octahydro- 1H- pyrrolo[3,2- c:4,5- c']dipyridine
Smiles: CN1CCc2c([C@H]1c1cccnc1)c1[C@H](N(C)CCc1n2C)c1cccnc1

STK540153
Synonyms: 7- [3- (4- ethylphenoxy)- 2- hydroxypropyl]- 3- methyl- 8- (piperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCc1ccc(cc1)OCC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCNCC1)O

STK840381
Synonyms: 7- [3- (4- chlorophenoxy)- 2- hydroxypropyl]- 3- methyl- 8- (pyrrolidin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCCC1)COc1ccc(cc1)Cl

STK540158
Synonyms: ethyl6- bromo- 5- [(pentafluorobenzyl)oxy]- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1c(F)c(F)c(c(c1F)F)F)c(c2)Br)c1ccccc1

STK540164
Synonyms: 8- [(2- hydroxyethyl)amino]- 1,3- dimethyl- 7- (propan- 2- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCCNc1nc2c(n1C(C)C)c(=O)n(c(=O)n2C)C

STK540167
Synonyms: 4- hydroxy- 3- [(4- methylphenyl)carbonyl]- 5H- spiro[furan- 2,2'- indene]- 1',3',5- trione
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)OC21C(=O)c1c(C2=O)cccc1

STK540168
Synonyms: methyl4- [(E)- {2- [(2,6- dimethylimidazo[1,2- a]pyridin- 3- yl)carbonyl]hydrazinylidene}methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/NC(=O)c1c(C)nc2n1cc(C)cc2

STK540169
Synonyms: 1- (2,6- dimethyl- 1H- indol- 3- yl)- 2- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl)ethanone
Smiles: Cc1ccc2c(c1)[nH]c(c2C(=O)CN1CCC2(CC1)OCCO2)C

STK540176
Synonyms: 2- (3- methoxyphenyl)- N- [3- (trifluoromethyl)phenyl]quinazolin- 4- amine
Smiles: COc1cccc(c1)c1nc(Nc2cccc(c2)C(F)(F)F)c2c(n1)cccc2

STK540177
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (5- methylfuran- 2- yl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1ccc(o1)C

STK840385
Synonyms: methyl5- (2- ethoxy- 2- oxo- 1- phenylethoxy)- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)C(c1ccccc1)Oc1ccc2c(c1)c(C(=O)OC)c(o2)C

STK540183
Synonyms: 2- methoxyethyl6- bromo- 5- [(2,4- dichlorobenzyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCc1ccc(cc1Cl)Cl)c(c2)Br

STK840387
Synonyms: [(3- chlorophenyl)(3- hydroxy- 5- propyl- 1H- pyrazol- 4- yl)methyl]propanedinitrile
Smiles: CCCc1[nH]nc(c1C(c1cccc(c1)Cl)C(C#N)C#N)O

STK540187
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- {4- [(3,4- dichlorobenzyl)oxy]- 3- methoxyphenyl}methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cn2nnc(n2)N)ccc1OCc1ccc(c(c1)Cl)Cl

STK540194
Synonyms: N'- [(E)- (2- hydroxy- 3- methoxy- 5- nitrophenyl)methylidene]- 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetohydrazide
Smiles: COc1cc(cc(c1O)/C=N/NC(=O)CSc1nnc(n1C)c1ccccc1)[N+](=O)[O-]

STK540200
Synonyms: 2- {3- [(3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)methyl]- 4- methoxyphenyl}- 2,3- dihydro- 4H- chromen- 4- one
Smiles: COc1ccc(cc1Cn1nc(c(c1C)[N+](=O)[O-])C)C1CC(=O)c2c(O1)cccc2

STK540201
Synonyms: 7- [2- hydroxy- 3- (2- methylphenoxy)propyl]- 3- methyl- 8- [(2- phenylethyl)amino]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(NCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C)COc1ccccc1C

STK540202
Synonyms: N'- [(E)- 1H- indol- 3- ylmethylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: O=C(Cn1cncn1)N/N=C/c1c[nH]c2c1cccc2

STK840393
Synonyms: 7- [3- (4- ethylphenoxy)- 2- hydroxypropyl]- 3- methyl- 8- [(2- phenylethyl)amino]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCc1ccc(cc1)OCC(Cn1c(NCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C)O

STK540204
Synonyms: 2- {[2- (phenylamino)phenyl]carbamoyl}cyclohexanecarboxylicacid
Smiles: O=C(C1CCCCC1C(=O)O)Nc1ccccc1Nc1ccccc1

STK540207
Synonyms: 7- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- N- (2- methylphenyl)heptanamide
Smiles: O=C(Nc1ccccc1C)CCCCCCN1C(=O)c2c(C1=O)cccc2

STK840395
Synonyms: ethyl5- {[(4- fluorophenyl)carbonyl]oxy}- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(cc2)OC(=O)c1ccc(cc1)F)c1ccccc1

STK540214
Synonyms: ethyl5- [(2,4- dichlorobenzyl)oxy]- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1ccc(cc1Cl)Cl)cc2)c1ccc(cc1)OC

STK540216
Synonyms: N'- [(E)- (5- methylfuran- 2- yl)methylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/c1ccc(o1)C

STK840399
Synonyms: 2- (2- {4- [(2E)- 3- (3,4,5- trimethoxyphenyl)prop- 2- enoyl]piperazin- 1- yl}ethyl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: COc1cc(/C=C/C(=O)N2CCN(CC2)CCn2c(=O)c3cccc4c3c(c2=O)ccc4)cc(c1OC)OC

STK540217
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1Z)- 1- (4- nitrophenyl)ethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C(\c1ccc(cc1)[N+](=O)[O-])/C

STK540220
Synonyms: 6- [9- bromo- 2- (naphthalen- 2- yl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)C1Oc2ccc(cc2C2N1N=C(C2)c1ccc2c(c1)cccc2)Br

STK840402
Synonyms: ethyl5- {[(4- fluorophenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1ccc(cc1)F

STK540223
Synonyms: 3- (4- benzylpiperazin- 1- yl)- N- [3- methyl- 1- (1- methyl- 1H- benzimidazol- 2- yl)- 1H- pyrazol- 5- yl]quinoxalin- 2- amine
Smiles: Cc1nn(c(c1)Nc1nc2ccccc2nc1N1CCN(CC1)Cc1ccccc1)c1nc2c(n1C)cccc2

STK840403
Synonyms: 7- [3- (4- chlorophenoxy)- 2- hydroxypropyl]- 8- (cyclohexylamino)- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(NC2CCCCC2)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)Cl

STK540224
Synonyms: N- [(4- benzylpiperazin- 1- yl)carbonothioyl]pyridine- 3- carboxamide
Smiles: S=C(N1CCN(CC1)Cc1ccccc1)NC(=O)c1cccnc1

STK540229
Synonyms: 2,2,3,3,4,4,4- heptafluoro- N- (1H- 1,2,4- triazol- 3- yl)butanamide
Smiles: O=C(C(C(C(F)(F)F)(F)F)(F)F)Nc1n[nH]cn1

STK840406
Synonyms: 7- (4- fluorobenzyl)- 8- {[3- (1H- imidazol- 1- yl)propyl]amino}- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccc(cc1)Cn1c(NCCCn2cncc2)nc2c1c(=O)n(c(=O)n2C)C

STK840408
Synonyms: ethyl6- bromo- 5- {[(2- methoxyphenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OC(=O)c1ccccc1OC)c(c2)Br

STK540237
Synonyms: 4- bromo- N- {[2- (furan- 2- ylcarbonyl)hydrazinyl]carbonothioyl}benzamide
Smiles: S=C(NC(=O)c1ccc(cc1)Br)NNC(=O)c1ccco1

STK540239
Synonyms: 2- {[3- (3- methylphenyl)- 4- oxo- 3,4,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl]sulfanyl}propanoicacid
Smiles: Cc1cccc(c1)n1c(SC(C(=O)O)C)nc2c(c1=O)c1CCCCc1s2

STK540240
Synonyms: 6- (hexylamino)- 3,3- dimethyl- 8- (2- methylpropyl)- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: CCCCCCNc1nc(CC(C)C)c2c(c1C#N)CC(OC2)(C)C

STK840412
Synonyms: (3- chloro- 1- benzothiophen- 2- yl){4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}methanone
Smiles: O=C(c1sc2c(c1Cl)cccc2)N1CCN(CC1)C/C=C/c1ccccc1

STK540249
Synonyms: N- [1- (phenylcarbonyl)- 1,2,3,4- tetrahydroquinolin- 6- yl]naphthalene- 1- carboxamide
Smiles: O=C(N1CCCc2c1ccc(c2)NC(=O)c1cccc2c1cccc2)c1ccccc1

STK540255
Synonyms: 4- benzyl- 1- (ethylsulfanyl)- 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: CCSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CC(OC3)C(C)C

STK540259
Synonyms: 6- [9- bromo- 2- (3,4- dimethoxyphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1ccc(cc1OC)C1=NN2C(C1)c1cc(Br)ccc1OC2c1ccc(c(c1C(=O)O)OC)OC

STK540260
Synonyms: 2- cyclopropyl- N'- [(E)- (2,4- dimethoxyphenyl)methylidene]quinoline- 4- carbohydrazide
Smiles: COc1ccc(c(c1)OC)/C=N/NC(=O)c1cc(nc2c1cccc2)C1CC1

STK540265
Synonyms: 2- (5- amino- 1H- tetrazol- 1- yl)- N'- [(E)- (2,4- dimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(OC)ccc1/C=N/NC(=O)Cn1nnnc1N

STK840419
Synonyms: 2- (2- {4- [(4- methylphenyl)sulfonyl]piperazin- 1- yl}ethyl)- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK840421
Synonyms: 8- (ethylamino)- 3- methyl- 7- (prop- 2- en- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCn1c(NCC)nc2c1c(=O)[nH]c(=O)n2C

STK840423
Synonyms: 2- methoxyethyl6- bromo- 5- [2- (4- fluorophenyl)- 2- oxoethoxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCC(=O)c1ccc(cc1)F)c(c2)Br

STK840425
Synonyms: 3- amino- 4,5,6- trimethyl- N- (5- methyl- 1,2- oxazol- 3- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: Cc1onc(c1)NC(=O)c1sc2c(c1N)c(C)c(c(n2)C)C

STK540279
Synonyms: 8- {[2- (dimethylamino)ethyl]amino}- 3- methyl- 7- (2- phenylethyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CN(CCNc1nc2c(n1CCc1ccccc1)c(=O)[nH]c(=O)n2C)C

STK540291
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(1Z)- 1- (naphthalen- 2- yl)ethylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C(\c1ccc2c(c1)cccc2)/C

STK540296
Synonyms: methyl5- chloro- 3- {[2- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C(N1CCC3(CC1)OCCO3)C)cc(cc2)Cl

STK540297
Synonyms: N'- {(1Z,2Z)- 2- methyl- 3- [4- (propan- 2- yl)phenyl]prop- 2- en- 1- ylidene}- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: CC(c1ccc(cc1)/C=C(\C=N/NC(=O)Cn1ncnc1)/C)C

STK540299
Synonyms: N- {[(3- cyano- 4,6- dimethylpyridin- 2- yl)sulfanyl]acetyl}glycine
Smiles: N#Cc1c(C)cc(nc1SCC(=O)NCC(=O)O)C

STK540300
Synonyms: 2- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 4,6- dimethylpyridine- 3- carbonitrile
Smiles: N#Cc1c(C)cc(nc1N1CCN(CC1)Cc1ccc2c(c1)OCO2)C

STK840434
Synonyms: N- cyclohexyl- 4- phenyltetrahydro- 2H- pyran- 4- carboxamide
Smiles: O=C(C1(CCOCC1)c1ccccc1)NC1CCCCC1

STK840435
Synonyms: prop- 2- yn- 1- yl(2E)- 3- (3- nitrophenyl)prop- 2- enoate
Smiles: C#CCOC(=O)/C=C/c1cccc(c1)[N+](=O)[O-]

STK840438
Synonyms: ethyl6- methoxy- 4- [(2- methoxyphenyl)amino]quinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccccc1OC)cc(cc2)OC

STK840440
Synonyms: (3E)- 1,1,1- trifluoro- 4- [(2- hydroxyphenyl)amino]but- 3- en- 2- one
Smiles: O=C(C(F)(F)F)/C=C/Nc1ccccc1O

STK840443
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 3- chloro- 6- methoxy- 1- benzothiophene- 2- carboxamide
Smiles: COc1ccc2c(c1)sc(c2Cl)C(=O)NCc1ccc2c(c1)OCO2

STK540318
Synonyms: 6- [9- bromo- 2- (naphthalen- 1- yl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)C1Oc2ccc(cc2C2N1N=C(C2)c1cccc2c1cccc2)Br

STK540320
Synonyms: 2- hydrazinyl- 3- (3- methylphenyl)- 3,5,6,7- tetrahydro- 4H- cyclopenta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: NNc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCC3

STK540324
Synonyms: 3- {[(E)- (4- hydroxy- 3- methoxyphenyl)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/c1ccc(c(c1)OC)O

STK840448
Synonyms: 1- (2,3- dihydroxypropyl)- 3,7- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCC(Cn1c(=O)c2n(C)cnc2n(c1=O)C)O

STK840449
Synonyms: ethyl5- (3,3- dimethyl- 2- oxobutoxy)- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCC(=O)C(C)(C)C)cc2)c1ccccc1

STK540330
Synonyms: 9'- bromo- 2'- phenyl- 1- (propan- 2- yl)- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: Brc1ccc2c(c1)C1CC(=NN1C1(O2)CCN(CC1)C(C)C)c1ccccc1

STK840450
Synonyms: 4- acetyl- 5- (4- bromophenyl)- 3- hydroxy- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: Brc1ccc(cc1)C1NC(=O)C(=C1C(=O)C)O

STK540332
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(1E)- 1- phenylethylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C(/c1ccccc1)\C

STK540333
Synonyms: 2- [(1- {[4- (morpholin- 4- ylsulfonyl)phenyl]carbonyl}piperidin- 4- yl)methyl]- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: O=C(c1ccc(cc1)S(=O)(=O)N1CCOCC1)N1CCC(CC1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3

STK840452
Synonyms: ethyl6- bromo- 5- (2- ethoxy- 2- oxo- 1- phenylethoxy)- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)C(c1ccccc1)Oc1cc2c(cc1Br)oc(c2C(=O)OCC)C

STK540335
Synonyms: N- benzylbenzo[cd]indol- 2- amine
Smiles: c1ccc(cc1)CNC1=Nc2c3c1cccc3ccc2

STK540336
Synonyms: 1- phenyl- N- [(2E)- 1,3,4,5- tetrahydro- 2H- 1- benzazepin- 2- ylidene]methanamine
Smiles: c1ccc(cc1)C/N=C/1\CCCc2c(N1)cccc2

STK840457
Synonyms: 2- (azepan- 1- yl)- N'- {(E)- [2- (benzyloxy)phenyl]methylidene}- 2- oxoacetohydrazide
Smiles: O=C(C(=O)N/N=C/c1ccccc1OCc1ccccc1)N1CCCCCC1

STK540340
Synonyms: N'- [(E)- (3,5- dibromo- 2- hydroxyphenyl)methylidene]- 2- (1H- 1,2,4- triazol- 1- yl)acetohydrazide
Smiles: Brc1cc(/C=N/NC(=O)Cn2ncnc2)c(c(c1)Br)O

STK840460
Synonyms: 2- methoxyethyl6- bromo- 5- methoxy- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OC)c(c2)Br

STK540343
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (5- methylfuran- 2- yl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1ccc(o1)C

STK540345
Synonyms: 2- {2- [4- (thiophen- 2- ylsulfonyl)piperazin- 1- yl]ethyl}- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: O=c1c2cccc3c2c(c(=O)n1CCN1CCN(CC1)S(=O)(=O)c1cccs1)ccc3

STK840462
Synonyms: methyl2- [(2,2,3,3,4,4,4- heptafluorobutanoyl)amino]benzoate
Smiles: COC(=O)c1ccccc1NC(=O)C(C(C(F)(F)F)(F)F)(F)F

STK540359
Synonyms: (2E)- 4- oxo- 4- [2- (pyridin- 2- ylcarbonyl)hydrazinyl]but- 2- enoicacid
Smiles: O=C(NNC(=O)c1ccccn1)/C=C/C(=O)O

STK840465
Synonyms: 6- (pyridin- 2- yl)- 1,3,5- triazine- 2,4- diamine
Smiles: Nc1nc(N)nc(n1)c1ccccn1

STK540361
Synonyms: 1- [6- hydroxy- 4- (4- methoxyphenyl)- 3,6- dimethyl- 4,5,6,7- tetrahydro- 2,1- benzoxazol- 5- yl]ethanone
Smiles: COc1ccc(cc1)C1c2c(C)onc2CC(C1C(=O)C)(C)O

STK540362
Synonyms: 6- [2- (2- chlorophenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1ccccc1Cl

STK540365
Synonyms: N'- [(E)- (5- bromo- 2,4- dimethoxyphenyl)methylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)CSc1ccccn1)Br

STK540366
Synonyms: 6- oxo- N- (pyridin- 3- ylmethyl)- 1,6- dihydropyridazine- 3- carboxamide
Smiles: O=C(c1ccc(=O)[nH]n1)NCc1cccnc1

STK540369
Synonyms: methyl5- bromo- 3- {[ethoxy(oxo)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)C(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OC

STK540371
Synonyms: 4- (4- methoxyphenyl)- 2- methyl- 5- oxo- 5H- indeno[1,2- b]pyridine- 3- carbonitrile
Smiles: COc1ccc(cc1)c1c(C#N)c(C)nc2c1C(=O)c1c2cccc1

STK540377
Synonyms: 1- ethyl- 6- fluoro- 4- oxo- 7- [4- (phenylacetyl)piperazin- 1- yl]- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=O)Cc1ccccc1)c(c2)F

STK840468
Synonyms: ethyl5- [2- (benzyloxy)- 2- oxoethoxy]- 2- tert- butyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCC(=O)OCc3ccccc3)ccc2oc1C(C)(C)C

STK540381
Synonyms: ethyl4- {6- fluoro- 3- [(furan- 2- ylmethyl)carbamoyl]- 1- hexyl- 4- oxo- 1,4- dihydroquinolin- 7- yl}piperazine- 1- carboxylate
Smiles: CCCCCCn1cc(C(=O)NCc2ccco2)c(=O)c2c1cc(N1CCN(CC1)C(=O)OCC)c(c2)F

STK840469
Synonyms: 3- (4- {[5- (2,3- dichlorophenyl)furan- 2- yl]carbonothioyl}piperazin- 1- yl)propanenitrile
Smiles: N#CCCN1CCN(CC1)C(=S)c1ccc(o1)c1cccc(c1Cl)Cl

STK540382
Synonyms: ethyl6- bromo- 2- tert- butyl- 5- [(pentafluorobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCc3c(F)c(F)c(c(c3F)F)F)c(cc2oc1C(C)(C)C)Br

STK840470
Synonyms: (2E)- 2- (pyridin- 2- ylmethylidene)- N- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)hydrazinecarboxamide
Smiles: O=C(NC12CC3CC(C2)CC(C1)C3)N/N=C/c1ccccn1

STK540384
Synonyms: propan- 2- yl2- methyl- 5- {2- oxo- 2- [(2E)- 2- (thiophen- 2- ylmethylidene)hydrazinyl]ethoxy}- 1- benzofuran- 3- carboxylate
Smiles: O=C(COc1ccc2c(c1)c(C(=O)OC(C)C)c(o2)C)N/N=C/c1cccs1

STK540389
Synonyms: N- (furan- 2- ylmethyl)but- 2- yn- 1- amine
Smiles: CC#CCNCc1ccco1

STK540392
Synonyms: 6- amino- 4- (3- methoxy- 4- propoxyphenyl)- 3- {[(4- methylphenyl)sulfanyl]methyl}- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: CCCOc1ccc(cc1OC)C1C(=C(N)Oc2c1c(CSc1ccc(cc1)C)[nH]n2)C#N

STK540393
Synonyms: N'- [(E)- (1- ethyl- 3,5- dimethyl- 1H- pyrazol- 4- yl)methylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: CCn1nc(c(c1C)/C=N/NC(=O)CSc1ccccn1)C

STK540394
Synonyms: 3- methyl- 7- (3- phenylpropyl)- 8- (prop- 2- en- 1- ylamino)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCNc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C

STK540396
Synonyms: (2E)- N- (2,4- dichlorophenyl)- 2- [(1,3- dimethyl- 1H- pyrazol- 4- yl)methylidene]hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1Cl)Cl)N/N=C/c1cn(nc1C)C

STK540397
Synonyms: ethyl2- methyl- 5- {2- oxo- 2- [(2E)- 2- (thiophen- 2- ylmethylidene)hydrazinyl]ethoxy}- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OCC(=O)N/N=C/c1cccs1)cc2

STK540399
Synonyms: ethyl6- bromo- 5- {[(4- bromophenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OC(=O)c1ccc(cc1)Br)c(c2)Br

STK840475
Synonyms: N- (3,5- dimethylphenyl)- 2- methylimidazo[1,2- a]pyridine- 3- carboxamide
Smiles: Cc1cc(cc(c1)C)NC(=O)c1c(C)nc2n1cccc2

STK840476
Synonyms: 1,3- dimethyl- 7- (3- methylbenzyl)- 8- (prop- 2- en- 1- ylsulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCSc1nc2c(n1Cc1cccc(c1)C)c(=O)n(c(=O)n2C)C

STK840477
Synonyms: 8- (butylamino)- 7- (4- fluorobenzyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCNc1nc2c(n1Cc1ccc(cc1)F)c(=O)n(c(=O)n2C)C

STK540415
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (4- ethoxy- 3- hydroxyphenyl)methylidene]acetohydrazide
Smiles: CCOc1ccc(cc1O)/C=N/NC(=O)Cn1nnc(n1)N

STK540417
Synonyms: N'- [(E)- (5- nitrothiophen- 2- yl)methylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/c1ccc(s1)[N+](=O)[O-]

STK840479
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 8- methyl- 4- oxo- 2- (propan- 2- yl)- 4H- chromen- 7- ylthiophene- 2- carboxylate
Smiles: O=C(c1cccs1)Oc1ccc2c(c1C)oc(c(c2=O)c1nc2c(s1)cccc2)C(C)C

STK540421
Synonyms: (Z)- 1- (4- methoxyphenyl)- N- [(9- methyl- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)methoxy]methanimine
Smiles: COc1ccc(cc1)/C=N\OCc1nn2c(n1)c1c(nc2)sc2c1CCN(C2)C

STK540423
Synonyms: N,N,2- trimethyl- 6,6- diphenylhex- 3- yn- 2- amine
Smiles: CN(C(C#CCC(c1ccccc1)c1ccccc1)(C)C)C

STK840486
Synonyms: propan- 2- yl2- methyl- 5- [(methylsulfonyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CC(OC(=O)c1c(C)oc2c1cc(cc2)OS(=O)(=O)C)C

STK540433
Synonyms: 8- methoxy- 3- {[(E)- pyridin- 4- ylmethylidene]amino}- 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/c1ccncc1

STK840488
Synonyms: propan- 2- yl5- (2- hydrazinyl- 2- oxoethoxy)- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: NNC(=O)COc1ccc2c(c1)c(C(=O)OC(C)C)c(o2)C

STK540438
Synonyms: 2- [4- (2- hydroxyethyl)piperazin- 1- yl]- 1- (2- methyl- 1H- indol- 3- yl)ethanone
Smiles: OCCN1CCN(CC1)CC(=O)c1c(C)[nH]c2c1cccc2

STK840495
Synonyms: (2Z)- 3- amino- 3- [(4- methoxyphenyl)amino]- 2- [(Z)- (3- oxo- 1,3- dihydro- 2H- indol- 2- ylidene)methyl]prop- 2- enenitrile
Smiles: COc1ccc(cc1)N/C(=C(/C=C/1\Nc2c(C1=O)cccc2)\C#N)/N

STK540444
Synonyms: 2,6,8- trimethyl- 3- [(4- methylpiperidin- 1- yl)methyl]quinolin- 4- ol
Smiles: CC1CCN(CC1)Cc1c(C)nc2c(c1O)cc(cc2C)C

STK540445
Synonyms: ethyl1- [2- (2,6- dimethyl- 1H- indol- 3- yl)- 2- oxoethyl]piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CC(=O)c1c(C)[nH]c2c1ccc(c2)C

STK840496
Synonyms: ethyl6- bromo- 5- {[(4- fluorophenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OC(=O)c1ccc(cc1)F)c(c2)Br

STK540452
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 8- methyl- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- yl4- fluorobenzoate
Smiles: Fc1ccc(cc1)C(=O)Oc1ccc2c(c1C)oc(c(c2=O)c1nc2c(s1)cccc2)C(F)(F)F

STK840497
Synonyms: 7- ethyl- 1,3- dimethyl- 8- (prop- 2- en- 1- ylamino)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: C=CCNc1nc2c(n1CC)c(=O)n(c(=O)n2C)C

STK540455
Synonyms: 7- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- N- phenylheptanamide
Smiles: O=C(Nc1ccccc1)CCCCCCN1C(=O)c2c(C1=O)cccc2

STK840499
Synonyms: 8- (butan- 2- ylamino)- 1,3- dimethyl- 7- (propan- 2- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCC(Nc1nc2c(n1C(C)C)c(=O)n(c(=O)n2C)C)C

STK840500
Synonyms: 1- (4- {[5- (2- nitrophenyl)furan- 2- yl]carbonothioyl}piperazin- 1- yl)ethanone
Smiles: CC(=O)N1CCN(CC1)C(=S)c1ccc(o1)c1ccccc1[N+](=O)[O-]

STK840502
Synonyms: 2- methoxyethyl6- bromo- 5- (2- tert- butoxy- 2- oxoethoxy)- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCC(=O)OC(C)(C)C)c(c2)Br

STK540467
Synonyms: 3- (ethylsulfanyl)- 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: CCSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)C(C)C

STK540472
Synonyms: 2,4- dichloro- 5- (morpholin- 4- yl)- 2- (prop- 2- en- 1- yl)cyclopent- 4- ene- 1,3- dione
Smiles: C=CCC1(Cl)C(=O)C(=C(C1=O)Cl)N1CCOCC1

STK540479
Synonyms: 3- {[(E)- (3- hydroxy- 1- benzothiophen- 2- yl)methylidene]amino}- 2- propylquinazolin- 4(3H)- one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1sc2c(c1O)cccc2

STK540483
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1E)- 1- phenylpropylidene]acetohydrazide
Smiles: CC/C(=N\NC(=O)CSc1nnc(n1C)c1cccc(c1)Br)/c1ccccc1

STK540484
Synonyms: N- (6- fluoro- 1,3- benzothiazol- 2- yl)- 4- hydroxy- 1- methyl- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: Fc1ccc2c(c1)sc(n2)NC(=O)c1c(O)c2ccccc2n(c1=O)C

STK840509
Synonyms: 2,8- dimethyl- 3- (morpholin- 4- ylmethyl)quinolin- 4(1H)- one
Smiles: Cc1[nH]c2c(C)cccc2c(=O)c1CN1CCOCC1

STK540485
Synonyms: ethyl5- (cyanomethoxy)- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCC#N)cc2)c1ccc(cc1)OC

STK840512
Synonyms: ethyl5- [(3- chlorobenzyl)oxy]- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1cccc(c1)Cl)cc2)c1ccc(cc1)OC

STK840514
Synonyms: N,N- dimethyl- 4- [(1E)- 2,2,2- trifluoro- N- hydroxyethanimidoyl]aniline
Smiles: O/N=C(/C(F)(F)F)\c1ccc(cc1)N(C)C

STK540494
Synonyms: 7- [3- (2,4- dichlorophenoxy)- 2- hydroxypropyl]- 8- {[2- (dimethylamino)ethyl]amino}- 3- methyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OC(Cn1c(NCCN(C)C)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1Cl)Cl

STK540498
Synonyms: methyl5,6- dimethoxy- 3- {[(3- methylphenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1cccc(c1)C)cc(c(c2)OC)OC

STK840520
Synonyms: 7,9- dimethyl- 1,4- dihydro[1,2,4]triazino[3,4- f]purine- 6,8(7H,9H)- dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc1n2CC=NN1

STK840522
Synonyms: 2- [2- (3,4- dimethoxyphenyl)ethyl]- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: COc1cc(ccc1OC)CCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK540509
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (3,4- dimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cn2nnc(n2)N)ccc1OC

STK540511
Synonyms: methyl6- bromo- 5- [(2- bromobenzyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COC(=O)c1c(C)oc2c1cc(OCc1ccccc1Br)c(c2)Br

STK540516
Synonyms: N- benzyl- 6- oxo- 1,6- dihydropyridazine- 3- carboxamide
Smiles: O=C(c1ccc(=O)[nH]n1)NCc1ccccc1

STK540519
Synonyms: 6- [2- (furan- 2- yl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]- 2,3- dimethoxybenzoicacid
Smiles: COc1c(OC)ccc(c1C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1ccco1

STK540520
Synonyms: 3- [4- (4- bromophenyl)- 1,3- thiazol- 2- yl]- 7- [(2- methylbenzyl)oxy]- 2H- chromen- 2- one
Smiles: Brc1ccc(cc1)c1csc(n1)c1cc2ccc(cc2oc1=O)OCc1ccccc1C

STK840527
Synonyms: methyl2- methyl- 5- [(thiophen- 2- ylcarbonyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: COC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1cccs1

STK840528
Synonyms: 5- [(4- chlorophenyl)sulfanyl]- 3- methyl- 6- phenylimidazo[2,1- b][1,3]thiazole
Smiles: Clc1ccc(cc1)Sc1c(nc2n1c(C)cs2)c1ccccc1

STK840531
Synonyms: ethyl2- tert- butyl- 5- [(2,6- dichlorobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCc3c(Cl)cccc3Cl)ccc2oc1C(C)(C)C

STK840534
Synonyms: N- {[2- (pyridin- 3- ylcarbonyl)hydrazinyl]carbonothioyl}furan- 2- carboxamide
Smiles: S=C(NC(=O)c1ccco1)NNC(=O)c1cccnc1

STK540531
Synonyms: 8- chloro- 3- ({(E)- [4- methoxy- 3- (piperidin- 1- ylmethyl)phenyl]methylidene}amino)- 1H- pyrimido[5,4- b]indole- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1CN1CCCCC1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)Cl

STK540537
Synonyms: 2,3- dimethoxy- 6- [2- (pyridin- 2- yl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazin- 5- yl]benzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)C1Oc2ccccc2C2N1N=C(C2)c1ccccn1

STK540539
Synonyms: N- [4- ({3- [4- (diphenylmethyl)piperazin- 1- yl]- 1,4- dioxo- 1,4- dihydronaphthalen- 2- yl}sulfamoyl)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)NC1=C(N2CCN(CC2)C(c2ccccc2)c2ccccc2)C(=O)c2c(C1=O)cccc2

STK540542
Synonyms: N'- {(E)- [3- methoxy- 4- (propan- 2- yloxy)phenyl]methylidene}- 2- methylquinoline- 4- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2cc(C)nc3c2cccc3)ccc1OC(C)C

STK540549
Synonyms: N- [biphenyl- 4- yl(phenyl)methyl]- 7- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)heptanamide
Smiles: O=C(NC(c1ccc(cc1)c1ccccc1)c1ccccc1)CCCCCCN1C(=O)c2c(C1=O)cccc2

STK540550
Synonyms: ethyl5- methoxy- 3- [(thiophen- 2- ylcarbonyl)amino]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)c1cccs1)cc(cc2)OC

STK540557
Synonyms: 1- (4- methoxyphenyl)- 5- oxo- 2- phenylpyrrolidine- 2- carbonitrile
Smiles: N#CC1(CCC(=O)N1c1ccc(cc1)OC)c1ccccc1

STK540560
Synonyms: 4- {(Z)- 2- (1,3- benzothiazol- 2- yl)- 1- [(2,2- dimethylpropanoyl)oxy]ethenyl}- 6- ethylbenzene- 1,3- diylbis(2,2- dimethylpropanoate)
Smiles: CCc1cc(/C(=C/c2sc3c(n2)cccc3)/OC(=O)C(C)(C)C)c(cc1OC(=O)C(C)(C)C)OC(=O)C(C)(C)C

STK840544
Synonyms: ethyl5- [2- (4- chlorophenyl)- 2- oxoethoxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OCC(=O)c1ccc(cc1)Cl)cc2

STK540566
Synonyms: 2- {[5- (4- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- thiophen- 2- ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1cccs1

STK540574
Synonyms: (6aR,6bS,9aR,10S)- 8- (4- bromophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: Brc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)N

STK840546
Synonyms: ethyl5- [2- (4- methoxyphenyl)- 2- oxoethoxy]- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCC(=O)c1ccc(cc1)OC)cc2)c1ccccc1

STK840551
Synonyms: 2- {[1- (quinolin- 8- ylsulfonyl)piperidin- 4- yl]methyl}- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: O=c1c2cccc3c2c(c(=O)n1CC1CCN(CC1)S(=O)(=O)c1cccc2c1nccc2)ccc3

STK840553
Synonyms: ethyl6- bromo- 5- [(cyclohexylcarbonyl)oxy]- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OC(=O)C1CCCCC1)c(c2)Br

STK540582
Synonyms: 2,4- bis(ethylsulfanyl)- 6- (propan- 2- yl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCSc1nc(SCC)nc2c1c1CC(OCc1s2)C(C)C

STK840555
Synonyms: N'- [(E)- (3,5- dibromo- 4- hydroxyphenyl)methylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/c1cc(Br)c(c(c1)Br)O

STK840556
Synonyms: ethyl2- (4- methoxyphenyl)- 5- [(3- nitrobenzyl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1cccc(c1)[N+](=O)[O-])cc2)c1ccc(cc1)OC

STK840557
Synonyms: 7- [2- hydroxy- 3- (4- methoxyphenoxy)propyl]- 1,3- dimethyl- 8- [(2- phenylethyl)amino]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1ccc(cc1)OCC(Cn1c(NCCc2ccccc2)nc2c1c(=O)n(C)c(=O)n2C)O

STK540593
Synonyms: ethyl3- ({[(1R,6R)- 6- benzylcyclohex- 3- en- 1- yl]carbonyl}amino)- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)[C@@H]1CC=CC[C@@H]1Cc1ccccc1)cc(cc2)OC

STK540601
Synonyms: propan- 2- yl5- (2- {2- [(4- methoxyphenyl)carbonyl]hydrazinyl}- 2- oxoethoxy)- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COc1ccc(cc1)C(=O)NNC(=O)COc1ccc2c(c1)c(C(=O)OC(C)C)c(o2)C