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

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STK779201
Synonyms: N- (3- methylpent- 1- yn- 3- yl)- 2- [5- (3- methylphenyl)- 2H- tetrazol- 2- yl]acetamide
Smiles: CCC(NC(=O)Cn1nnc(n1)c1cccc(c1)C)(C#C)C

STK779202
Synonyms: methyl1- (2,4- dichlorobenzyl)- 1H- pyrazole- 3- carboxylate
Smiles: COC(=O)c1ccn(n1)Cc1ccc(cc1Cl)Cl

STK779204
Synonyms: N- {4- [chloro(difluoro)methoxy]phenyl}- 2- [5- (4- chlorophenyl)- 2H- tetrazol- 2- yl]acetamide
Smiles: O=C(Cn1nnc(n1)c1ccc(cc1)Cl)Nc1ccc(cc1)OC(Cl)(F)F

STK779205
Synonyms: 2- [(5- methyl- 5H- [1,2,4]triazino[5,6- b]indol- 3- yl)sulfanyl]- N- (thiophen- 2- ylmethyl)acetamide
Smiles: O=C(CSc1nnc2c(n1)n(C)c1c2cccc1)NCc1cccs1

STK779209
Synonyms: methyl3- {2- [(5- carbamoyl- 2- phenyl- 2H- 1,2,3- triazol- 4- yl)amino]- 2- oxoethoxy}benzoate
Smiles: COC(=O)c1cccc(c1)OCC(=O)Nc1nn(nc1C(=O)N)c1ccccc1

STK685283
Synonyms: ethyl4- [({[(4E)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylideneamino]oxy}acetyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CO/N=C/1\CCCc2c1non2

STK779210
Synonyms: 2,4- dichlorobenzyl2- amino- 4- methyl- 1,3- thiazole- 5- carboxylate
Smiles: Clc1ccc(c(c1)Cl)COC(=O)c1sc(nc1C)N

STK779211
Synonyms: N- {4- [chloro(difluoro)methoxy]phenyl}- 2- ({4- methyl- 5- [(5- phenyl- 2H- tetrazol- 2- yl)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)OC(Cl)(F)F)CSc1nnc(n1C)Cn1nnc(n1)c1ccccc1

STK779212
Synonyms: 4- {4- [(2,6- dichlorobenzyl)oxy]- 1,2,5- thiadiazol- 3- yl}morpholine
Smiles: Clc1cccc(c1COc1nsnc1N1CCOCC1)Cl

STK779214
Synonyms: [4- amino- 6- (dimethylamino)- 1,3,5- triazin- 2- yl]methyl4- (4H- 1,2,4- triazol- 4- yl)benzoate
Smiles: Nc1nc(COC(=O)c2ccc(cc2)n2cnnc2)nc(n1)N(C)C

STK779216
Synonyms: 2- {[(4E)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylideneamino]oxy}- N- (4- ethylphenyl)acetamide
Smiles: CCc1ccc(cc1)NC(=O)CO/N=C/1\CCCc2c1non2

STK779221
Synonyms: 2- [(5- ethoxy- 1H- benzimidazol- 2- yl)sulfanyl]- 1- [3- (phenylsulfonyl)- 2- (propan- 2- yl)imidazolidin- 1- yl]ethanone
Smiles: CCOc1ccc2c(c1)nc([nH]2)SCC(=O)N1CCN(C1C(C)C)S(=O)(=O)c1ccccc1

STK779222
Synonyms: N- (4- bromo- 2- fluorophenyl)- 1,3- dimethyl- 1H- pyrazole- 4- sulfonamide
Smiles: Brc1ccc(c(c1)F)NS(=O)(=O)c1cn(nc1C)C

STK779225
Synonyms: 1- ethyl- N- [3- (trifluoromethyl)phenyl]- 1H- pyrazole- 5- carboxamide
Smiles: CCn1nccc1C(=O)Nc1cccc(c1)C(F)(F)F

STK779228
Synonyms: N- [4- (acetylamino)phenyl]- 1- ethyl- 1H- pyrazole- 5- carboxamide
Smiles: CCn1nccc1C(=O)Nc1ccc(cc1)NC(=O)C

STK779230
Synonyms: N- (2,4- difluorophenyl)- 1- ethyl- 1H- pyrazole- 5- carboxamide
Smiles: CCn1nccc1C(=O)Nc1ccc(cc1F)F

STK779232
Synonyms: 1- methyl- N- [2- (trifluoromethyl)phenyl]- 1H- pyrazole- 5- carboxamide
Smiles: O=C(c1ccnn1C)Nc1ccccc1C(F)(F)F

STK685292
Synonyms: 1- (3,5- dichlorophenyl)- 3- (4- oxo- 1- phenyl- 1,3,8- triazaspiro[4.5]dec- 8- yl)pyrrolidine- 2,5- dione
Smiles: Clc1cc(Cl)cc(c1)N1C(=O)CC(C1=O)N1CCC2(CC1)C(=O)NCN2c1ccccc1

STK779238
Synonyms: 3- methylphenyl{4- [1- phenyl- 3- (trifluoromethyl)- 1H- pyrazol- 5- yl]phenyl}sulfamate
Smiles: Cc1cccc(c1)OS(=O)(=O)Nc1ccc(cc1)c1cc(nn1c1ccccc1)C(F)(F)F

STK685295
Synonyms: 4- (4- {[(4- chloro- 3- methylphenoxy)acetyl]amino}- 1H- pyrazol- 1- yl)butanoicacid
Smiles: O=C(Nc1cnn(c1)CCCC(=O)O)COc1ccc(c(c1)C)Cl

STK779240
Synonyms: N- [1- (naphthalen- 1- ylmethyl)- 1H- pyrazol- 3- yl]- 1,3- benzodioxole- 5- carboxamide
Smiles: O=C(c1ccc2c(c1)OCO2)Nc1ccn(n1)Cc1cccc2c1cccc2

STK779245
Synonyms: N- [3,5- dimethyl- 1- (3- methylbenzyl)- 1H- pyrazol- 4- yl]furan- 2- carboxamide
Smiles: Cc1cccc(c1)Cn1nc(c(c1C)NC(=O)c1ccco1)C

STK779246
Synonyms: N- [3,5- dimethyl- 1- (3- methylbenzyl)- 1H- pyrazol- 4- yl]- 1,3- benzodioxole- 5- carboxamide
Smiles: Cc1cccc(c1)Cn1nc(c(c1C)NC(=O)c1ccc2c(c1)OCO2)C

STK779248
Synonyms: 3- (4- methoxyphenyl)- N- [3- methyl- 1- (naphthalen- 1- ylmethyl)- 1H- pyrazol- 5- yl]propanamide
Smiles: COc1ccc(cc1)CCC(=O)Nc1cc(nn1Cc1cccc2c1cccc2)C

STK779250
Synonyms: N- [3- methyl- 1- (naphthalen- 1- ylmethyl)- 1H- pyrazol- 5- yl]furan- 2- carboxamide
Smiles: Cc1nn(c(c1)NC(=O)c1ccco1)Cc1cccc2c1cccc2

STK779252
Synonyms: N- (1- benzyl- 1H- pyrazol- 3- yl)- 2- (3,4- dimethoxyphenyl)acetamide
Smiles: COc1cc(ccc1OC)CC(=O)Nc1ccn(n1)Cc1ccccc1

STK685297
Synonyms: ethyl(5- {[(4- fluorophenyl)carbonyl]amino}- 3- methyl- 1H- pyrazol- 1- yl)acetate
Smiles: CCOC(=O)Cn1nc(cc1NC(=O)c1ccc(cc1)F)C

STK779256
Synonyms: ethyl(5- {[(3,4- dimethoxyphenyl)acetyl]amino}- 3- methyl- 1H- pyrazol- 1- yl)acetate
Smiles: CCOC(=O)Cn1nc(cc1NC(=O)Cc1ccc(c(c1)OC)OC)C

STK779258
Synonyms: methyl4- {[1- (2- ethoxy- 2- oxoethyl)- 3- methyl- 1H- pyrazol- 5- yl]carbamoyl}benzoate
Smiles: CCOC(=O)Cn1nc(cc1NC(=O)c1ccc(cc1)C(=O)OC)C

STK779259
Synonyms: ethyl{3- methyl- 5- [(pyridin- 3- ylcarbonyl)amino]- 1H- pyrazol- 1- yl}acetate
Smiles: CCOC(=O)Cn1nc(cc1NC(=O)c1cccnc1)C

STK779260
Synonyms: ethyl{3- methyl- 5- [(pyridin- 4- ylcarbonyl)amino]- 1H- pyrazol- 1- yl}acetate
Smiles: CCOC(=O)Cn1nc(cc1NC(=O)c1ccncc1)C

STK779261
Synonyms: N- [1- (4- fluorobenzyl)- 3- methyl- 1H- pyrazol- 5- yl]- 2- (4- nitro- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Nc1cc(nn1Cc1ccc(cc1)F)C)Cn1ncc(c1)[N+](=O)[O-]

STK779264
Synonyms: N- (1- benzyl- 1H- pyrazol- 3- yl)pyridine- 3- carboxamide
Smiles: O=C(c1cccnc1)Nc1ccn(n1)Cc1ccccc1

STK685301
Synonyms: N- (1- benzyl- 1H- pyrazol- 3- yl)furan- 2- carboxamide
Smiles: O=C(c1ccco1)Nc1ccn(n1)Cc1ccccc1

STK779266
Synonyms: 2- (3,4- dimethoxyphenyl)- N- [1- (4- fluorobenzyl)- 3- methyl- 1H- pyrazol- 5- yl]acetamide
Smiles: COc1cc(ccc1OC)CC(=O)Nc1cc(nn1Cc1ccc(cc1)F)C

STK685302
Synonyms: 3- [(furan- 2- ylcarbonyl)amino]- 3- (4- propoxyphenyl)propanoicacid
Smiles: CCCOc1ccc(cc1)C(NC(=O)c1ccco1)CC(=O)O

STK779271
Synonyms: N'- {(E)- [3- (4- fluorophenyl)- 1H- pyrazol- 4- yl]methylidene}- 3- nitrobenzohydrazide
Smiles: Fc1ccc(cc1)c1n[nH]cc1/C=N/NC(=O)c1cccc(c1)[N+](=O)[O-]

STK685315
Synonyms: methyl3- [({4- [bis(2- chloroethyl)sulfamoyl]phenyl}carbonyl)amino]- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: ClCCN(S(=O)(=O)c1ccc(cc1)C(=O)Nc1c([nH]c2c1cc(F)cc2)C(=O)OC)CCCl

STK685317
Synonyms: methyl3- [({4- [bis(2- chloroethyl)sulfamoyl]phenyl}carbonyl)amino]- 6- methoxy- 1H- indole- 2- carboxylate
Smiles: ClCCN(S(=O)(=O)c1ccc(cc1)C(=O)Nc1c([nH]c2c1ccc(c2)OC)C(=O)OC)CCCl

STK779280
Synonyms: 2- [(6- methyl- 3- oxo- 1,3- dihydrofuro[3,4- c]pyridin- 4- yl)sulfanyl]- N- (4- nitrophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)[N+](=O)[O-])CSc1nc(C)cc2c1C(=O)OC2

STK779283
Synonyms: 5- chloro- 4,6- dimethyl- 2- (1- methylhydrazinyl)pyridine- 3- carbonitrile
Smiles: N#Cc1c(nc(c(c1C)Cl)C)N(N)C

STK779288
Synonyms: 2- methoxy- 4- (methoxymethyl)- 6- methylpyridine- 3- carboxamide
Smiles: COCc1cc(C)nc(c1C(=O)N)OC

STK779289
Synonyms: N- (4- chlorobenzyl)- 2- [(6- methyl- 3- oxo- 1,3- dihydrofuro[3,4- c]pyridin- 4- yl)sulfanyl]acetamide
Smiles: O=C(CSc1nc(C)cc2c1C(=O)OC2)NCc1ccc(cc1)Cl

STK779291
Synonyms: N- (2- hydroxyethyl)- 4- (methoxymethyl)- 6- methyl- 3- (1H- pyrrol- 1- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COCc1cc(C)nc2c1c(n1cccc1)c(s2)C(=O)NCCO

STK779295
Synonyms: 1,1'- {[6- (dipropan- 2- ylamino)- 1,3,5- triazine- 2,4- diyl]bis(5- methyl- 1H- 1,2,3- triazole- 1,4- diyl)}diethanone
Smiles: CC(N(c1nc(nc(n1)n1nnc(c1C)C(=O)C)n1nnc(c1C)C(=O)C)C(C)C)C

STK779297
Synonyms: 3- (1H- benzimidazol- 2- yl)- 1,1,1- trifluoropropan- 2- one
Smiles: O=C(C(F)(F)F)Cc1nc2c([nH]1)cccc2

STK685320
Synonyms: 6- {[cyclohexyl(ethyl)amino]methyl}- 1,3- dimethyl[1,3]thiazolo[2,3- f]purine- 2,4(1H,3H)- dione
Smiles: CCN(C1CCCCC1)Cc1csc2n1c1c(=O)n(C)c(=O)n(c1n2)C

STK685321
Synonyms: 6- [(dibutylamino)methyl]- 1,3- dimethyl[1,3]thiazolo[2,3- f]purine- 2,4(1H,3H)- dione
Smiles: CCCCN(Cc1csc2n1c1c(=O)n(C)c(=O)n(c1n2)C)CCCC

STK779298
Synonyms: 1,3- dimethyl- 6- [(phenylamino)methyl][1,3]thiazolo[2,3- f]purine- 2,4(1H,3H)- dione
Smiles: O=c1c2c(nc3n2c(CNc2ccccc2)cs3)n(c(=O)n1C)C

STK779299
Synonyms: 8- (2- methoxyphenyl)- 7- (3- methoxyphenyl)- 1,3- dimethyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COc1cccc(c1)c1cn2c(n1c1ccccc1OC)nc1c2c(=O)n(C)c(=O)n1C

STK779300
Synonyms: 8- (4- fluorophenyl)- 7- (3- methoxyphenyl)- 1,3- dimethyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COc1cccc(c1)c1cn2c(n1c1ccc(cc1)F)nc1c2c(=O)n(C)c(=O)n1C

STK685327
Synonyms: 3- ({[4- (acetylamino)phenyl]sulfonyl}amino)- 3- (4- tert- butylphenyl)propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)C(C)(C)C)NS(=O)(=O)c1ccc(cc1)NC(=O)C

STK779304
Synonyms: N- (4- amino- 1,2,5- oxadiazol- 3- yl)- 2- [(3- cyano- 6,7,8,9- tetrahydro- 5H- cyclohepta[b]pyridin- 2- yl)sulfanyl]acetamide
Smiles: N#Cc1cc2CCCCCc2nc1SCC(=O)Nc1nonc1N

STK779306
Synonyms: 4- hydroxy- 8- nitrothieno[2,3- b:4,5- b']dipyridine- 2,7(1H,6H)- dione
Smiles: O=c1cc(O)c2c([nH]1)c1cc([N+](=O)[O-])c(=O)[nH]c1s2

STK779308
Synonyms: (3- amino- 6- ethyl- 5,6,7,8- tetrahydrothieno[2,3- b][1,6]naphthyridin- 2- yl)(3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: CCN1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)N1CCc2c(C1)cccc2

STK779310
Synonyms: N- benzyl- 9,10- dioxo- 1- (phenylsulfonyl)- 9,10- dihydroanthracene- 2- carboxamide
Smiles: O=C1c2ccccc2C(=O)c2c1ccc(c2S(=O)(=O)c1ccccc1)C(=O)NCc1ccccc1

STK779312
Synonyms: 3- (benzyloxy)- 5- (benzylsulfanyl)- 1,2- thiazole- 4- carbonitrile
Smiles: N#Cc1c(SCc2ccccc2)snc1OCc1ccccc1

STK779314
Synonyms: 2- (3,4- diethoxyphenyl)- 4,5- diphenyl- 1H- imidazole
Smiles: CCOc1ccc(cc1OCC)c1nc(c([nH]1)c1ccccc1)c1ccccc1

STK779315
Synonyms: 2- (4- bromo- 1,3- benzodioxol- 5- yl)- 4,5- diphenyl- 1H- imidazole
Smiles: Brc1c2OCOc2ccc1c1nc(c([nH]1)c1ccccc1)c1ccccc1

STK779317
Synonyms: 3- amino- N- (4- methoxybenzyl)- 6- methyl- 5,6,7,8- tetrahydrothieno[2,3- b][1,6]naphthyridine- 2- carboxamide
Smiles: COc1ccc(cc1)CNC(=O)c1sc2c(c1N)cc1c(n2)CCN(C1)C

STK685332
Synonyms: 3- (4- tert- butylphenyl)- 3- {[(4- methoxyphenyl)carbonyl]amino}propanoicacid
Smiles: COc1ccc(cc1)C(=O)NC(c1ccc(cc1)C(C)(C)C)CC(=O)O

STK685334
Synonyms: N- [(4aS,8aR)- 1- methyldecahydroquinolin- 4- yl]acetamide
Smiles: CC(=O)NC1CCN([C@H]2[C@H]1CCCC2)C

STK685335
Synonyms: (4aS,8aR)- 1- methyldecahydroquinolin- 4- amine
Smiles: CN1CCC([C@H]2[C@H]1CCCC2)N

STK685336
Synonyms: 2- [(1H- indazol- 5- ylamino)methyl]phenol
Smiles: Oc1ccccc1CNc1ccc2c(c1)cn[nH]2

STK779320
Synonyms: 4- bromo- 2- ({[3- (trifluoromethyl)phenyl]amino}methyl)phenol
Smiles: Brc1ccc(c(c1)CNc1cccc(c1)C(F)(F)F)O

STK779321
Synonyms: N- (3,4- dimethoxyphenyl)- 1- ethyl- 1H- pyrazole- 5- carboxamide
Smiles: COc1cc(ccc1OC)NC(=O)c1ccnn1CC

STK685338
Synonyms: 2- (2- chlorophenyl)- 1- oxo- 1,2,3,6,7,7a- hexahydro- 3a,6- epoxyisoindole- 7- carboxylicacid
Smiles: OC(=O)C1C2C=CC3(C1C(=O)N(C3)c1ccccc1Cl)O2

STK685339
Synonyms: 2- (2,4- dimethoxybenzyl)- 1- oxo- 1,2,3,6,7,7a- hexahydro- 3a,6- epoxyisoindole- 7- carboxylicacid
Smiles: COc1cc(OC)ccc1CN1CC23C(C1=O)C(C(O3)C=C2)C(=O)O

STK685340
Synonyms: 1- oxo- 2- (pyridin- 3- yl)- 1,2,3,6,7,7a- hexahydro- 3a,6- epoxyisoindole- 7- carboxylicacid
Smiles: OC(=O)C1C2C=CC3(C1C(=O)N(C3)c1cccnc1)O2

STK779324
Synonyms: 2- (1- methylpiperidin- 4- yl)- 1- oxo- 1,2,3,6,7,7a- hexahydro- 3a,6- epoxyisoindole- 7- carboxylicacid
Smiles: CN1CCC(CC1)N1CC23C(C1=O)C(C(O3)C=C2)C(=O)O

STK779325
Synonyms: 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- oxo- 1,2,3,6,7,7a- hexahydro- 3a,6- epoxyisoindole- 7- carboxylicacid
Smiles: Cc1cc(no1)N1CC23C(C1=O)C(C(O2)C=C3)C(=O)O

STK779328
Synonyms: methylN- [(3H- imidazo[4,5- b]pyridin- 2- ylsulfanyl)acetyl]leucinate
Smiles: COC(=O)C(NC(=O)CSc1nc2c([nH]1)nccc2)CC(C)C

STK685349
Synonyms: 2- (piperidin- 1- yl)- 4H- 1,3,4- thiadiazin- 5(6H)- one
Smiles: O=C1CSC(=NN1)N1CCCCC1

STK779329
Synonyms: 1- (6,7- difluoro- 3- methyl- 1,4- dioxidoquinoxalin- 2- yl)ethanone
Smiles: Fc1cc2[n+]([O-])c(C(=O)C)c([n+](c2cc1F)[O-])C

STK779330
Synonyms: 1- (6,7- difluoro- 3- methylquinoxalin- 2- yl)ethanone
Smiles: CC(=O)c1nc2cc(F)c(cc2nc1C)F

STK779332
Synonyms: N- ({4- [3,5- bis(trifluoromethyl)- 1H- pyrazol- 1- yl]phenyl}carbamoyl)- 3- methoxybenzamide
Smiles: COc1cccc(c1)C(=O)NC(=O)Nc1ccc(cc1)n1nc(cc1C(F)(F)F)C(F)(F)F

STK779334
Synonyms: N- ({4- [3,5- bis(trifluoromethyl)- 1H- pyrazol- 1- yl]phenyl}carbamoyl)- 3- methylbenzamide
Smiles: O=C(NC(=O)c1cccc(c1)C)Nc1ccc(cc1)n1nc(cc1C(F)(F)F)C(F)(F)F

STK779335
Synonyms: N- ({4- [3,5- bis(trifluoromethyl)- 1H- pyrazol- 1- yl]phenyl}carbamoyl)- 2- methylbenzamide
Smiles: O=C(NC(=O)c1ccccc1C)Nc1ccc(cc1)n1nc(cc1C(F)(F)F)C(F)(F)F

STK685350
Synonyms: 3- {[(4- methoxyphenyl)acetyl]amino}- 3- (4- propoxyphenyl)propanoicacid
Smiles: CCCOc1ccc(cc1)C(CC(=O)O)NC(=O)Cc1ccc(cc1)OC

STK685351
Synonyms: 3- [(3,3- diphenylpropanoyl)amino]- 3- (4- propoxyphenyl)propanoicacid
Smiles: CCCOc1ccc(cc1)C(NC(=O)CC(c1ccccc1)c1ccccc1)CC(=O)O

STK685353
Synonyms: 3- (4- methoxyphenyl)- 3- [({3- [(2- methylpropanoyl)amino]phenyl}carbonyl)amino]propanoicacid
Smiles: COc1ccc(cc1)C(NC(=O)c1cccc(c1)NC(=O)C(C)C)CC(=O)O

STK779336
Synonyms: 5- {[3- (2H- benzotriazol- 2- yl)- 4- ethoxybenzyl]sulfanyl}- 1,3,4- thiadiazol- 2- amine
Smiles: CCOc1ccc(cc1n1nc2c(n1)cccc2)CSc1nnc(s1)N

STK779341
Synonyms: 2- {[(3- nitro- 1H- pyrazol- 1- yl)acetyl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxamide
Smiles: O=C(Nc1sc2c(c1C(=O)N)CCCC2)Cn1ccc(n1)[N+](=O)[O-]

STK779343
Synonyms: N- (3,4- difluorophenyl)- 2- (5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])Nc1ccc(c(c1)F)F

STK779349
Synonyms: 6- acetyl- 3- amino- N- (4- chlorophenyl)- 4- (trifluoromethyl)- 5,6,7,8- tetrahydrothieno[2,3- b][1,6]naphthyridine- 2- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1sc2c(c1N)c(c1c(n2)CCN(C1)C(=O)C)C(F)(F)F

STK779351
Synonyms: 2- amino- 4- [3- (4- fluorophenyl)- 1H- pyrazol- 4- yl]- 6- (hydroxymethyl)- 8- oxo- 4,8- dihydropyrano[3,2- b]pyran- 3- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1c[nH]nc1c1ccc(cc1)F)oc(cc2=O)CO

STK685356
Synonyms: 1,5- dimethyl- 2,4- dinitrobenzene
Smiles: Cc1cc(C)c(cc1[N+](=O)[O-])[N+](=O)[O-]

STK685359
Synonyms: 2- [2- chloro- 5- (trifluoromethyl)phenyl]- 1- oxo- 1,2,3,6,7,7a- hexahydro- 3a,6- epoxyisoindole- 7- carboxylicacid
Smiles: OC(=O)C1C2C=CC3(C1C(=O)N(C3)c1cc(ccc1Cl)C(F)(F)F)O2

STK685360
Synonyms: 1- oxo- 2- [1- (pyridin- 3- yl)ethyl]- 1,2,3,6,7,7a- hexahydro- 3a,6- epoxyisoindole- 7- carboxylicacid
Smiles: OC(=O)C1C2C=CC3(C1C(=O)N(C3)C(c1cccnc1)C)O2

STK779352
Synonyms: 5- bromo- 7- methyl- 1H- indazole
Smiles: Brc1cc(C)c2c(c1)cn[nH]2

STK685361
Synonyms: 1- benzyl- 4- ethynylpiperidin- 4- ol
Smiles: C#CC1(O)CCN(CC1)Cc1ccccc1

STK779355
Synonyms: (2Z)- 2- {(1S,2S,5R)- 2- [4- (2- fluorophenyl)- 5- thioxo- 4,5- dihydro- 1H- tetrazol- 1- yl]- 6,8- dioxabicyclo[3.2.1]oct- 4- ylidene}hydrazinecarbothioamide(non- preferredname)
Smiles: NC(=S)N/N=C\1/C[C@@H]([C@@H]2O[C@H]1OC2)n1nnn(c1=S)c1ccccc1F

STK779360
Synonyms: 3- methoxybenzyl5- amino- 2- phenyl- 2H- 1,2,3- triazole- 4- carboxylate
Smiles: COc1cccc(c1)COC(=O)c1nn(nc1N)c1ccccc1

STK779361
Synonyms: 1- (2,6- dichlorobenzyl)- 4- nitro- 1H- pyrazole- 3- carboxamide
Smiles: Clc1cccc(c1Cn1nc(c(c1)[N+](=O)[O-])C(=O)N)Cl

STK779364
Synonyms: 2- chloro- 6- fluorobenzyl5- amino- 2- phenyl- 2H- 1,2,3- triazole- 4- carboxylate
Smiles: O=C(c1nn(nc1N)c1ccccc1)OCc1c(F)cccc1Cl

STK685362
Synonyms: 5- (1,3- benzodioxol- 5- yl)- 3- phenyl- 2- thioxo- 2,3- dihydro[1,3]thiazolo[4,5- d]pyrimidin- 7(6H)- one
Smiles: O=c1[nH]c(nc2c1sc(=S)n2c1ccccc1)c1ccc2c(c1)OCO2

STK685363
Synonyms: 3- [(chloroacetyl)amino]- 2- hydroxybenzoicacid
Smiles: Oc1c(NC(=O)CCl)cccc1C(=O)O

STK685364
Synonyms: 2- hydroxy- 3- {[(2- methylphenyl)carbonyl]amino}benzoicacid
Smiles: O=C(c1ccccc1C)Nc1cccc(c1O)C(=O)O

STK685365
Synonyms: 3- {[(4- tert- butylphenyl)carbonyl]amino}- 2- hydroxybenzoicacid
Smiles: O=C(c1ccc(cc1)C(C)(C)C)Nc1cccc(c1O)C(=O)O

STK685366
Synonyms: 3- {[(2- chlorophenyl)carbonyl]amino}- 2- hydroxybenzoicacid
Smiles: O=C(c1ccccc1Cl)Nc1cccc(c1O)C(=O)O

STK685367
Synonyms: 3- [(furan- 2- ylcarbonyl)amino]- 2- hydroxybenzoicacid
Smiles: O=C(c1ccco1)Nc1cccc(c1O)C(=O)O

STK685368
Synonyms: 2- hydroxy- 3- {[(4- methoxyphenyl)carbonyl]amino}benzoicacid
Smiles: COc1ccc(cc1)C(=O)Nc1cccc(c1O)C(=O)O

STK685369
Synonyms: 2- hydroxy- 3- [(phenylcarbonyl)amino]benzoicacid
Smiles: O=C(c1ccccc1)Nc1cccc(c1O)C(=O)O

STK685371
Synonyms: 2- hydroxy- 3- {[(3- nitrophenyl)carbonyl]amino}benzoicacid
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])Nc1cccc(c1O)C(=O)O

STK685372
Synonyms: 3- {[(4- chlorophenyl)carbonyl]amino}- 2- hydroxybenzoicacid
Smiles: Clc1ccc(cc1)C(=O)Nc1cccc(c1O)C(=O)O

STK685373
Synonyms: 2- hydroxy- 3- {[(2E)- 3- phenylprop- 2- enoyl]amino}benzoicacid
Smiles: O=C(Nc1cccc(c1O)C(=O)O)/C=C/c1ccccc1

STK685374
Synonyms: 3- {[(3- bromophenyl)carbonyl]amino}- 2- hydroxybenzoicacid
Smiles: Brc1cccc(c1)C(=O)Nc1cccc(c1O)C(=O)O

STK685376
Synonyms: 2- hydroxy- 3- [(phenylacetyl)amino]benzoicacid
Smiles: O=C(Nc1cccc(c1O)C(=O)O)Cc1ccccc1

STK685377
Synonyms: 2- hydroxy- 3- [(thiophen- 2- ylcarbonyl)amino]benzoicacid
Smiles: O=C(c1cccs1)Nc1cccc(c1O)C(=O)O

STK685378
Synonyms: 2- hydroxy- 3- {[(4- methylphenyl)carbonyl]amino}benzoicacid
Smiles: Cc1ccc(cc1)C(=O)Nc1cccc(c1O)C(=O)O

STK685379
Synonyms: [4- (piperazin- 1- yl)phenyl](pyridin- 4- yl)methanone
Smiles: O=C(c1ccncc1)c1ccc(cc1)N1CCNCC1

STK779378
Synonyms: N- [2- (1H- benzimidazol- 2- yl)ethyl]- 3- (4- methoxyphenyl)propanamide
Smiles: COc1ccc(cc1)CCC(=O)NCCc1nc2c([nH]1)cccc2

STK685380
Synonyms: 4- (2,3- dimethoxyphenyl)- 1- (dimethylamino)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: COc1cccc(c1OC)C1CC(=O)N(C2=C1C(=O)CCC2)N(C)C

STK685381
Synonyms: 1- (dimethylamino)- 4- [4- (prop- 2- en- 1- yloxy)phenyl]- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: C=CCOc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CCC2)N(C)C

STK685383
Synonyms: 4- (4- bromothiophen- 2- yl)- 1- (dimethylamino)- 7,7- dimethyl- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Brc1csc(c1)C1CC(=O)N(C2=C1C(=O)CC(C2)(C)C)N(C)C

STK779380
Synonyms: dimethyl5,5'- [(2,5- dimethylthiophen- 3- yl)methanediyl]bis(4- hydroxy- 2- methylthiophene- 3- carboxylate)
Smiles: COC(=O)c1c(C)sc(c1O)C(c1sc(c(c1O)C(=O)OC)C)c1cc(sc1C)C

STK779382
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 1- (3- fluorophenyl)- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: Fc1cccc(c1)N1C(=O)CC(C2=C1COC2=O)c1ccc2c(c1)OCO2

STK779383
Synonyms: 4- (2- chlorophenyl)- 1- [3- (trifluoromethyl)phenyl]- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: O=C1CC(C2=C(N1c1cccc(c1)C(F)(F)F)COC2=O)c1ccccc1Cl

STK779385
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 1- [4- (trifluoromethyl)phenyl]- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: O=C1CC(c2ccc3c(c2)OCO3)C2=C(N1c1ccc(cc1)C(F)(F)F)COC2=O

STK685386
Synonyms: 4- [3- (4- methoxyphenyl)- 1H- pyrazol- 4- yl]- 6- methyl- 4,6- dihydro- 2H- pyrano[3,2- c]quinoline- 2,5(3H)- dione
Smiles: COc1ccc(cc1)c1n[nH]cc1C1CC(=O)Oc2c1c(=O)n(c1c2cccc1)C

STK779394
Synonyms: 2- (7,7- dimethyl- 2,5- dioxo- 4- phenyl- 3,4,5,6,7,8- hexahydroquinolin- 1(2H)- yl)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: N#Cc1c(sc2c1CCCC2)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccccc1

STK779400
Synonyms: 1- (3,5- dichlorophenyl)- 4- (3- methoxyphenyl)- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: COc1cccc(c1)C1CC(=O)N(C2=C1C(=O)OC2)c1cc(Cl)cc(c1)Cl

STK779401
Synonyms: 1- (dimethylamino)- 4- (4- hydroxy- 3- methoxyphenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: COc1cc(ccc1O)C1CC(=O)N(C2=C1C(=O)CCC2)N(C)C

STK779405
Synonyms: ethyl5- amino- 6- cyano- 2- methyl- 7- (pyridin- 3- yl)- 7H- thieno[3,2- b]pyran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)sc2c1OC(=C(C2c1cccnc1)C#N)N

STK779408
Synonyms: 4- (3- chlorophenyl)- 1- [3- (trifluoromethyl)phenyl]- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: Clc1cccc(c1)C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)C(F)(F)F

STK779409
Synonyms: 4- (4- methoxyphenyl)- 1- [3- (trifluoromethyl)phenyl]- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: COc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)C(F)(F)F

STK779410
Synonyms: 4- (3- bromophenyl)- 1- [3- (trifluoromethyl)phenyl]- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: Brc1cccc(c1)C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)C(F)(F)F

STK779412
Synonyms: 4- (3- nitrophenyl)- 1- [3- (trifluoromethyl)phenyl]- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: O=C1CC(c2cccc(c2)[N+](=O)[O-])C2=C(N1c1cccc(c1)C(F)(F)F)COC2=O

STK779416
Synonyms: 4- (1H- indol- 3- yl)- 6- methyl- 4,6- dihydro- 2H- pyrano[3,2- c]quinoline- 2,5(3H)- dione
Smiles: O=C1CC(c2c[nH]c3c2cccc3)c2c(O1)c1ccccc1n(c2=O)C

STK779433
Synonyms: 4- (2,5- dimethoxyphenyl)- 1- [3- (trifluoromethyl)phenyl]- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: COc1ccc(c(c1)C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)C(F)(F)F)OC

STK779434
Synonyms: 3- (3,4- dimethoxybenzyl)- 4,5- diphenyl- 1,3- oxazol- 2(3H)- one
Smiles: COc1cc(ccc1OC)Cn1c(=O)oc(c1c1ccccc1)c1ccccc1

STK779436
Synonyms: 4- (2,3- dimethoxyphenyl)- 1- (dimethylamino)- 7- phenyl- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: COc1cccc(c1OC)C1CC(=O)N(C2=C1C(=O)CC(C2)c1ccccc1)N(C)C

STK779440
Synonyms: ethyl5- amino- 7- (1,3- benzodioxol- 5- yl)- 6- cyano- 2- methyl- 7H- thieno[3,2- b]pyran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)sc2c1OC(=C(C2c1ccc2c(c1)OCO2)C#N)N

STK779441
Synonyms: ethyl5- amino- 6- cyano- 2- methyl- 7- (3- methylthiophen- 2- yl)- 7H- thieno[3,2- b]pyran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)sc2c1OC(=C(C2c1sccc1C)C#N)N

STK779446
Synonyms: 4- (2- chloro- 6- fluorophenyl)- 1- (3,5- dimethylphenyl)- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: Cc1cc(C)cc(c1)N1C(=O)CC(C2=C1COC2=O)c1c(F)cccc1Cl

STK779447
Synonyms: 4- (4- ethoxyphenyl)- 1- [3- (trifluoromethyl)phenyl]- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: CCOc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)C(F)(F)F

STK779449
Synonyms: 4- (2- fluorophenyl)- 1- [3- (trifluoromethyl)phenyl]- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: O=C1CC(C2=C(N1c1cccc(c1)C(F)(F)F)COC2=O)c1ccccc1F

STK779457
Synonyms: 2- [4- (3,4- dimethoxyphenyl)- 7,7- dimethyl- 2,5- dioxo- 3,4,5,6,7,8- hexahydroquinolin- 1(2H)- yl]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: COc1cc(ccc1OC)C1CC(=O)N(C2=C1C(=O)CC(C2)(C)C)c1sc2c(c1C#N)CCCC2

STK779479
Synonyms: 1- (3- fluorophenyl)- 4- (2- methoxyphenyl)- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: COc1ccccc1C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)F

STK779494
Synonyms: 4- (2,5- dimethoxyphenyl)- 1- (4- ethylphenyl)- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: COc1ccc(cc1C1CC(=O)N(C2=C1C(=O)OC2)c1ccc(cc1)CC)OC

STK779495
Synonyms: 4- (4- nitrophenyl)- 1- [3- (trifluoromethyl)phenyl]- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: O=C1OCC2=C1C(CC(=O)N2c1cccc(c1)C(F)(F)F)c1ccc(cc1)[N+](=O)[O-]

STK779497
Synonyms: 4- (2,3- dimethoxyphenyl)- 1- [3- (trifluoromethyl)phenyl]- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: COc1c(OC)cccc1C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)C(F)(F)F

STK779511
Synonyms: 4- (3- nitrophenyl)- 1- [4- (trifluoromethyl)phenyl]- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: O=C1CC(c2cccc(c2)[N+](=O)[O-])C2=C(N1c1ccc(cc1)C(F)(F)F)COC2=O

STK779512
Synonyms: 2- [(3- oxocyclohex- 1- en- 1- yl)amino]- 4,5,6,7,8,8a- hexahydro- 3aH- cyclohepta[b]thiophene- 3- carbonitrile
Smiles: N#CC1=C(NC2=CC(=O)CCC2)SC2C1CCCCC2

STK779514
Synonyms: 4- (2,4- dichlorophenyl)- 1- (dimethylamino)- 7- phenyl- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Clc1ccc(c(c1)Cl)C1CC(=O)N(C2=C1C(=O)CC(C2)c1ccccc1)N(C)C

STK685393
Synonyms: 2- (methylsulfanyl)[1,3]thiazolo[4,5- b]pyridine- 5,7- diol
Smiles: CSc1nc2c(s1)c(O)cc(n2)O

STK779515
Synonyms: 6- acetyl- 3- amino- N- (2- chlorophenyl)- 4- (trifluoromethyl)- 5,6,7,8- tetrahydrothieno[2,3- b][1,6]naphthyridine- 2- carboxamide
Smiles: CC(=O)N1CCc2c(C1)c(c1c(n2)sc(c1N)C(=O)Nc1ccccc1Cl)C(F)(F)F

STK779522
Synonyms: N- [1- (3- methylbenzyl)- 1H- pyrazol- 3- yl]furan- 2- carboxamide
Smiles: Cc1cccc(c1)Cn1ccc(n1)NC(=O)c1ccco1

STK779523
Synonyms: N- [3,5- dimethyl- 1- (3- methylbenzyl)- 1H- pyrazol- 4- yl]- 2- (4- fluorophenoxy)acetamide
Smiles: O=C(Nc1c(C)nn(c1C)Cc1cccc(c1)C)COc1ccc(cc1)F

STK779524
Synonyms: 2- (4- fluorophenoxy)- N- [3- methyl- 1- (naphthalen- 1- ylmethyl)- 1H- pyrazol- 5- yl]acetamide
Smiles: O=C(Nc1cc(nn1Cc1cccc2c1cccc2)C)COc1ccc(cc1)F

STK779526
Synonyms: ethyl(5- {[(2,4- difluorophenoxy)acetyl]amino}- 3- methyl- 1H- pyrazol- 1- yl)acetate
Smiles: CCOC(=O)Cn1nc(cc1NC(=O)COc1ccc(cc1F)F)C

STK779527
Synonyms: ethyl(3- methyl- 5- {[(3,4,5- trimethoxyphenyl)carbonyl]amino}- 1H- pyrazol- 1- yl)acetate
Smiles: CCOC(=O)Cn1nc(cc1NC(=O)c1cc(OC)c(c(c1)OC)OC)C

STK779529
Synonyms: N- [1- (4- fluorobenzyl)- 3- methyl- 1H- pyrazol- 5- yl]pyrazine- 2- carboxamide
Smiles: Fc1ccc(cc1)Cn1nc(cc1NC(=O)c1cnccn1)C

STK779530
Synonyms: N- (1- benzyl- 1H- pyrazol- 3- yl)pyrazine- 2- carboxamide
Smiles: O=C(c1cnccn1)Nc1ccn(n1)Cc1ccccc1

STK685397
Synonyms: 3,4- dimethoxy- N- [2- methyl- 4- (5- methyl- 1,2,4- oxadiazol- 3- yl)phenyl]benzamide
Smiles: COc1cc(ccc1OC)C(=O)Nc1ccc(cc1C)c1noc(n1)C

STK779536
Synonyms: 5- bromo- N- [2- methyl- 4- (5- methyl- 1,2,4- oxadiazol- 3- yl)phenyl]furan- 2- carboxamide
Smiles: Brc1ccc(o1)C(=O)Nc1ccc(cc1C)c1noc(n1)C

STK779537
Synonyms: 4- (3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)- N- (2- methoxyphenyl)butanamide
Smiles: COc1ccccc1NC(=O)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK685399
Synonyms: 4- (3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)- N- [4- (propan- 2- yl)phenyl]butanamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK779548
Synonyms: N- (2- ethoxyphenyl)- 2- (4- iodo- 3,5- dimethyl- 1H- pyrazol- 1- yl)acetamide
Smiles: CCOc1ccccc1NC(=O)Cn1nc(c(c1C)I)C

STK685401
Synonyms: N- (6- nitro- 1,3- benzothiazol- 2- yl)- 2- (3- nitro- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1ccc(n1)[N+](=O)[O-])Nc1nc2c(s1)cc(cc2)[N+](=O)[O-]

STK779554
Synonyms: ethyl4- {[4- (3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)butanoyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK779564
Synonyms: N- (3,5- dichlorophenyl)- 4- (3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)butanamide
Smiles: O=C(Nc1cc(Cl)cc(c1)Cl)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK779566
Synonyms: N- (4- bromo- 2- fluorophenyl)- 4- (3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)butanamide
Smiles: O=C(Nc1ccc(cc1F)Br)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK779573
Synonyms: 4- (3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)- N- (5- methyl- 1,2- oxazol- 3- yl)butanamide
Smiles: O=C(Nc1noc(c1)C)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK779576
Synonyms: N- (3- acetylphenyl)- 4- (3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)butanamide
Smiles: O=C(Nc1cccc(c1)C(=O)C)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK779586
Synonyms: N- (1,3- benzodioxol- 5- yl)- 4- (3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)butanamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK779591
Synonyms: 4- (3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)- 1- (3,5- dimethyl- 1H- pyrazol- 1- yl)butan- 1- one
Smiles: Cc1cc(n(n1)C(=O)CCCn1nc(c(c1C)[N+](=O)[O-])C)C

STK779592
Synonyms: 2- (4- bromo- 5- methyl- 3- nitro- 1H- pyrazol- 1- yl)- N- (2,4- difluorophenyl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Br)[N+](=O)[O-])Nc1ccc(cc1F)F

STK779599
Synonyms: ethyl4- {[(5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)Cn1nc(cc1C)[N+](=O)[O-]

STK779601
Synonyms: 1- ethyl- 5'- phenyl- 3'H- spiro[indole- 3,2'- [1,3,4]thiadiazol]- 2(1H)- one
Smiles: CCN1c2ccccc2C2(C1=O)NN=C(S2)c1ccccc1

STK779614
Synonyms: 5- amino- 4- (4- fluorophenyl)- 7- (thiophen- 2- yl)- 2,3,4,7- tetrahydrothieno[3,2- b]pyridine- 6- carbonitrile1,1- dioxide
Smiles: N#CC1=C(N)N(c2ccc(cc2)F)C2=C(C1c1cccs1)S(=O)(=O)CC2

STK779615
Synonyms: 5- amino- 4- (4- fluorophenyl)- 7- (furan- 2- yl)- 2,3,4,7- tetrahydrothieno[3,2- b]pyridine- 6- carbonitrile1,1- dioxide
Smiles: N#CC1=C(N)N(c2ccc(cc2)F)C2=C(C1c1ccco1)S(=O)(=O)CC2

STK779616
Synonyms: 5- amino- 4- (4- fluorophenyl)- 7- (pyridin- 4- yl)- 2,3,4,7- tetrahydrothieno[3,2- b]pyridine- 6- carbonitrile1,1- dioxide
Smiles: N#CC1=C(N)N(c2ccc(cc2)F)C2=C(C1c1ccncc1)S(=O)(=O)CC2

STK779622
Synonyms: 5- amino- 4- (4- fluorophenyl)- 7- (pyridin- 3- yl)- 2,3,4,7- tetrahydrothieno[3,2- b]pyridine- 6- carbonitrile1,1- dioxide
Smiles: N#CC1=C(N)N(c2ccc(cc2)F)C2=C(C1c1cccnc1)S(=O)(=O)CC2

STK685405
Synonyms: 4- (4- {[(2,4- dichlorophenoxy)acetyl]amino}- 1H- pyrazol- 1- yl)butanoicacid
Smiles: O=C(Nc1cnn(c1)CCCC(=O)O)COc1ccc(cc1Cl)Cl

STK779634
Synonyms: N- [2- (1H- benzimidazol- 2- yl)ethyl]pyridine- 2- carboxamide
Smiles: O=C(c1ccccn1)NCCc1nc2c([nH]1)cccc2

STK685407
Synonyms: N- [2- (1H- benzimidazol- 2- yl)ethyl]pyridine- 3- carboxamide
Smiles: O=C(c1cccnc1)NCCc1nc2c([nH]1)cccc2

STK779635
Synonyms: N- [2- (1H- benzimidazol- 2- yl)ethyl]pyridine- 4- carboxamide
Smiles: O=C(c1ccncc1)NCCc1nc2c([nH]1)cccc2

STK685412
Synonyms: methyl(2Z)- 2- [(4- fluorophenyl)imino]- 3- (3- methylbutyl)- 4- oxo- 3,4- dihydro- 2H- 1,3- thiazine- 6- carboxylate
Smiles: COC(=O)c1cc(=O)n(/c(=N/c2ccc(cc2)F)/s1)CCC(C)C

STK779644
Synonyms: 1'- [(4- methylphenyl)carbonyl]- 5',6',7',8'- tetrahydro- 1'H- spiro[cyclohexane- 1,2'- quinazolin]- 4'(3'H)- one
Smiles: Cc1ccc(cc1)C(=O)N1C2=C(CCCC2)C(=O)NC21CCCCC2

STK685416
Synonyms: 2- (dimethylamino)ethyl6- bromo- 2- [(2,4- dibromophenoxy)methyl]- 5- methoxy- 1- methyl- 1H- indole- 3- carboxylate
Smiles: COc1cc2c(C(=O)OCCN(C)C)c(n(c2cc1Br)C)COc1ccc(cc1Br)Br

STK685417
Synonyms: {6- bromo- 2- [(4- chlorophenoxy)methyl]- 5- methoxy- 1- methyl- 1H- indol- 3- yl}(4- methylpiperazin- 1- yl)methanone
Smiles: COc1cc2c(C(=O)N3CCN(CC3)C)c(n(c2cc1Br)C)COc1ccc(cc1)Cl

STK685422
Synonyms: 4- (benzylamino)- 1- (3- chlorobenzyl)pyrimidin- 2(1H)- one
Smiles: Clc1cccc(c1)Cn1ccc(nc1=O)NCc1ccccc1

STK779656
Synonyms: 5- (benzylamino)- 1- [(benzyloxy)methyl]pyrimidine- 2,4(1H,3H)- dione
Smiles: O=c1[nH]c(=O)n(cc1NCc1ccccc1)COCc1ccccc1

STK685428
Synonyms: 1- {[(3,5- dimethylbenzyl)oxy]methyl}- 5- [(2- phenylethyl)amino]pyrimidine- 2,4(1H,3H)- dione
Smiles: Cc1cc(COCn2cc(NCCc3ccccc3)c(=O)[nH]c2=O)cc(c1)C

STK779658
Synonyms: methylN- {[(4- amino- 6- oxo- 1,6- dihydropyrimidin- 2- yl)sulfanyl]acetyl}- S- benzylcysteinate
Smiles: COC(=O)C(NC(=O)CSc1nc(N)cc(=O)[nH]1)CSCc1ccccc1

STK779670
Synonyms: N- (4- chlorophenyl)- 2- oxo- 1,2,5,6,7,8- hexahydroquinoline- 3- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1cc2CCCCc2[nH]c1=O

STK685429
Synonyms: N- benzyl- 4- oxo- 4H- pyrido[1,2- a]pyrimidine- 3- carboxamide
Smiles: O=C(c1cnc2n(c1=O)cccc2)NCc1ccccc1

STK685430
Synonyms: 3- (morpholin- 4- ylcarbonyl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: O=C(c1cnc2n(c1=O)cccc2)N1CCOCC1

STK685431
Synonyms: 4- (4- tert- butylphenyl)- 1- (dimethylamino)- 7,7- dimethyl- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1CC(C)(C)CC2=C1C(CC(=O)N2N(C)C)c1ccc(cc1)C(C)(C)C

STK779673
Synonyms: N- [2- methyl- 4- (5- methyl- 1,2,4- oxadiazol- 3- yl)phenyl]- 2- oxo- 2H- chromene- 3- carboxamide
Smiles: Cc1onc(n1)c1ccc(c(c1)C)NC(=O)c1cc2ccccc2oc1=O

STK779675
Synonyms: 2- chloro- N- cycloheptyl- 5- (4H- 1,2,4- triazol- 4- yl)benzamide
Smiles: O=C(c1cc(ccc1Cl)n1cnnc1)NC1CCCCCC1

STK779676
Synonyms: 3- chloro- N- [(8- methylimidazo[1,2- a]pyridin- 2- yl)methyl]aniline
Smiles: Clc1cccc(c1)NCc1cn2c(n1)c(C)ccc2

STK779679
Synonyms: N- (2,3- dichlorophenyl)- 2- {[(4E)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylideneamino]oxy}acetamide
Smiles: O=C(Nc1cccc(c1Cl)Cl)CO/N=C/1\CCCc2c1non2

STK685437
Synonyms: [1- (4- methylphenyl)- 1H- 1,2,3- triazole- 4,5- diyl]dimethanol
Smiles: OCc1c(CO)nnn1c1ccc(cc1)C

STK779699
Synonyms: dimethyl[(3- methylquinoxalin- 2- yl)methyl]phosphonate
Smiles: COP(=O)(Cc1nc2ccccc2nc1C)OC

STK779701
Synonyms: 5- fluoro- 2- methoxy- N- [2- (5- methoxy- 2- methyl- 1H- indol- 3- yl)ethyl]benzenesulfonamide
Smiles: COc1ccc2c(c1)c(CCNS(=O)(=O)c1cc(F)ccc1OC)c([nH]2)C

STK685440
Synonyms: (4- {[(5- fluoro- 2- methoxyphenyl)sulfonyl]amino}phenyl)aceticacid
Smiles: COc1ccc(cc1S(=O)(=O)Nc1ccc(cc1)CC(=O)O)F

STK685441
Synonyms: [4- ({[2- methoxy- 5- (propan- 2- yl)phenyl]sulfonyl}amino)phenyl]aceticacid
Smiles: COc1ccc(cc1S(=O)(=O)Nc1ccc(cc1)CC(=O)O)C(C)C

STK779707
Synonyms: 3- (propan- 2- yloxy)- 5- (propylsulfanyl)- 1,2- thiazole- 4- carbonitrile
Smiles: CCCSc1snc(c1C#N)OC(C)C

STK685442
Synonyms: ethyl5- ({[(3,4- dimethylphenyl)sulfonyl]amino}methyl)furan- 2- carboxylate
Smiles: CCOC(=O)c1ccc(o1)CNS(=O)(=O)c1ccc(c(c1)C)C

STK685443
Synonyms: 4,4'- methanediylbis(5- ethyl- 2,4- dihydro- 3H- 1,2,4- triazol- 3- one)
Smiles: CCc1n[nH]c(=O)n1Cn1c(CC)n[nH]c1=O

STK685444
Synonyms: 4- ethoxy- N- (1H- indazol- 6- yl)- 3- methylbenzenesulfonamide
Smiles: CCOc1ccc(cc1C)S(=O)(=O)Nc1ccc2c(c1)[nH]nc2

STK779710
Synonyms: 5- chloro- 2- ethoxy- N- (1H- indazol- 6- yl)benzenesulfonamide
Smiles: CCOc1ccc(cc1S(=O)(=O)Nc1ccc2c(c1)[nH]nc2)Cl

STK779713
Synonyms: 5- fluoro- N- (1H- indazol- 6- yl)- 2- methoxybenzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)Nc1ccc2c(c1)[nH]nc2)F

STK685446
Synonyms: 4- fluoro- N- (1H- indazol- 6- yl)- 3- methoxybenzenesulfonamide
Smiles: COc1cc(ccc1F)S(=O)(=O)Nc1ccc2c(c1)[nH]nc2

STK779720
Synonyms: N- [2- (7- chloro- 2- methyl- 1H- indol- 3- yl)ethyl]- 3- ethoxy- 4- fluorobenzenesulfonamide
Smiles: CCOc1cc(ccc1F)S(=O)(=O)NCCc1c(C)[nH]c2c1cccc2Cl

STK779722
Synonyms: 2- ethoxy- N- [2- (5- fluoro- 2- methyl- 1H- indol- 3- yl)ethyl]- 5- methylbenzenesulfonamide
Smiles: CCOc1ccc(cc1S(=O)(=O)NCCc1c(C)[nH]c2c1cc(F)cc2)C

STK779728
Synonyms: 3- fluoro- N- {4- [1- phenyl- 3- (trifluoromethyl)- 1H- pyrazol- 5- yl]phenyl}benzamide
Smiles: Fc1cccc(c1)C(=O)Nc1ccc(cc1)c1cc(nn1c1ccccc1)C(F)(F)F

STK685448
Synonyms: 3- [5- (4- fluorophenyl)- 1,2,4- oxadiazol- 3- yl]- 2- methoxyquinoline
Smiles: COc1nc2ccccc2cc1c1noc(n1)c1ccc(cc1)F

STK685449
Synonyms: N- [1- (3- methylbenzyl)- 1H- pyrazol- 3- yl]- 2- [(4- methyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccn(n1)Cc1cccc(c1)C)CSc1nncn1C

STK779731
Synonyms: (5Z)- 2- imino- 5- {[3- (2- methylpropyl)- 1- phenyl- 1H- pyrazol- 4- yl]methylidene}- 3- (1,3- thiazol- 2- yl)- 1,3- thiazolidin- 4- one
Smiles: CC(Cc1nn(cc1/C=C/1\SC(=N)N(C1=O)c1nccs1)c1ccccc1)C

STK779732
Synonyms: N- [4- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- 1,2,5- oxadiazol- 3- yl]acetamide
Smiles: CC(=O)Nc1nonc1N1C(=O)c2c(C1=O)cccc2

STK779733
Synonyms: 1- (3,4- dimethoxyphenyl)[1]benzofuro[2,3- e][2,1]benzoxazole
Smiles: COc1cc(ccc1OC)c1onc2c1c1oc3c(c1cc2)cccc3

STK779734
Synonyms: 4- (2- nitro- 1- benzothiophen- 3- yl)morpholine
Smiles: [O-][N+](=O)c1sc2c(c1N1CCOCC1)cccc2

STK685451
Synonyms: ethyl3- [(2- chlorophenyl)carbamoyl]pyrazine- 2- carboxylate
Smiles: CCOC(=O)c1nccnc1C(=O)Nc1ccccc1Cl

STK685454
Synonyms: 3- [(4- methylphenyl)carbamoyl]pyrazine- 2- carboxylicacid
Smiles: O=C(c1nccnc1C(=O)O)Nc1ccc(cc1)C

STK685455
Synonyms: 3- {[2- (3,4- diethoxyphenyl)ethyl]carbamoyl}pyrazine- 2- carboxylicacid
Smiles: CCOc1cc(CCNC(=O)c2nccnc2C(=O)O)ccc1OCC

STK779740
Synonyms: ethylN- {[2,4- dichloro- 5- (cyclopropylsulfamoyl)phenyl]carbonyl}glycinate
Smiles: CCOC(=O)CNC(=O)c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1

STK685456
Synonyms: 2,4- dichloro- 5- (cyclopropylsulfamoyl)- N- (pyridin- 3- ylmethyl)benzamide
Smiles: O=C(c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1)NCc1cccnc1

STK779744
Synonyms: 2,4- dichloro- 5- (cyclopropylsulfamoyl)- N- (furan- 2- ylmethyl)benzamide
Smiles: O=C(c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1)NCc1ccco1

STK685457
Synonyms: 6- amino- 3- propyl- 3,4- dihydro- 1,3,5- triazine- 1(2H)- carbonitrile
Smiles: CCCN1CN(C#N)C(=NC1)N

STK779749
Synonyms: 1- methyl- N- [3- (trifluoromethyl)phenyl]- 1H- pyrazole- 4- sulfonamide
Smiles: Cn1ncc(c1)S(=O)(=O)Nc1cccc(c1)C(F)(F)F

STK779750
Synonyms: N- (3,4- dichlorophenyl)- 1- methyl- 1H- pyrazole- 4- sulfonamide
Smiles: Cn1ncc(c1)S(=O)(=O)Nc1ccc(c(c1)Cl)Cl

STK779751
Synonyms: N- (2,4- difluorophenyl)- 1- methyl- 1H- pyrazole- 4- sulfonamide
Smiles: Fc1ccc(c(c1)F)NS(=O)(=O)c1cnn(c1)C

STK779753
Synonyms: N- (4- chlorophenyl)- 1- methyl- 1H- pyrazole- 4- sulfonamide
Smiles: Clc1ccc(cc1)NS(=O)(=O)c1cnn(c1)C

STK779755
Synonyms: 4- (2- chloro- 6- fluorophenyl)- 1- (dimethylamino)- 7- phenyl- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1CC(CC2=C1C(CC(=O)N2N(C)C)c1c(F)cccc1Cl)c1ccccc1

STK779767
Synonyms: N- cyclopropyl- 4,5- difluoro- 2- methylbenzamide
Smiles: O=C(c1cc(F)c(cc1C)F)NC1CC1

STK685464
Synonyms: 4- [3- (3- fluorophenyl)- 1H- pyrazol- 4- yl]- 3,4- dihydro[1,3,5]triazino[1,2- a]benzimidazol- 2- amine
Smiles: NC1=Nc2nc3c(n2C(N1)c1c[nH]nc1c1cccc(c1)F)cccc3

STK685465
Synonyms: 4- [3- (4- fluorophenyl)- 1H- pyrazol- 4- yl]- 3,4- dihydro[1,3,5]triazino[1,2- a]benzimidazol- 2- amine
Smiles: Fc1ccc(cc1)c1n[nH]cc1C1NC(=Nc2n1c1ccccc1n2)N

STK685467
Synonyms: N- [(2E)- 2- (acetylamino)- 3- phenylprop- 2- enoyl]tryptophan
Smiles: CC(=O)N/C(=C/c1ccccc1)/C(=O)NC(C(=O)O)Cc1c[nH]c2c1cccc2

STK779775
Synonyms: 2- [4- (1,3- benzodioxol- 5- yl)- 2,5- dioxo- 3,4,5,6,7,8- hexahydroquinolin- 1(2H)- yl]- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophene- 3- carbonitrile
Smiles: N#Cc1c(sc2c1CCCCC2)N1C(=O)CC(C2=C1CCCC2=O)c1ccc2c(c1)OCO2

STK779786
Synonyms: 3- [({[4- (prop- 2- en- 1- yl)- 5- (pyridin- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2)C(=O)O)nnc1c1cccnc1

STK779787
Synonyms: 2,6- dimethyl- 5- phenyl- 1- [2- (tricyclo[3.3.1.1~3,7~]dec- 1- yloxy)ethyl]pyrimidin- 4(1H)- one
Smiles: Cc1nc(=O)c(c(n1CCOC12CC3CC(C2)CC(C1)C3)C)c1ccccc1

STK779789
Synonyms: 1- (1H- indazol- 6- yl)- 2,6- dimethyl- 5- phenylpyrimidin- 4(1H)- one
Smiles: O=c1nc(C)n(c(c1c1ccccc1)C)c1ccc2c(c1)[nH]nc2

STK685479
Synonyms: 4- (1,2- dimethyl- 1H- indol- 3- yl)- 3,4- dihydro[1,3,5]triazino[1,2- a]benzimidazol- 2- amine
Smiles: NC1=Nc2nc3c(n2C(N1)c1c(C)n(c2c1cccc2)C)cccc3

STK685481
Synonyms: 6- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 3- phenyl[1,2,4]triazolo[4,3- b]pyridazine
Smiles: c1ccc(cc1)c1nnc2n1nc(cc2)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK779795
Synonyms: N- cycloheptyl- 2- (5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])NC1CCCCCC1

STK779796
Synonyms: 5- amino- N- (2- fluorophenyl)- 1- [2- (trifluoromethyl)phenyl]- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: Fc1ccccc1NC(=O)c1nnn(c1N)c1ccccc1C(F)(F)F

STK779797
Synonyms: 2,4- dichloro- 5- (cyclopropylsulfamoyl)- N- (tricyclo[3.3.1.1~3,7~]dec- 1- ylmethyl)benzamide
Smiles: O=C(c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1)NCC12CC3CC(C2)CC(C1)C3

STK779798
Synonyms: 2,4- dichloro- 5- (cyclopropylsulfamoyl)- N- [2- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)ethyl]benzamide
Smiles: O=C(c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1)NCCC12CC3CC(C2)CC(C1)C3

STK779799
Synonyms: 2,4- dichloro- 5- (cyclopropylsulfamoyl)- N- (2- phenylethyl)benzamide
Smiles: O=C(c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1)NCCc1ccccc1

STK779800
Synonyms: 2,4- dichloro- 5- (cyclopropylsulfamoyl)- N- (2,3- dimethylphenyl)benzamide
Smiles: O=C(c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1)Nc1cccc(c1C)C

STK685485
Synonyms: 4- amino- 5- [(pyridin- 4- ylmethyl)sulfanyl]- 4H- 1,2,4- triazole- 3- thiol
Smiles: Nn1c(SCc2ccncc2)nnc1S

STK685487
Synonyms: 2- (3,4- dihydroisoquinolin- 2(1H)- yl)- N- [4- (morpholin- 4- ylsulfonyl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N1CCOCC1)CN1CCc2c(C1)cccc2

STK685488
Synonyms: 4- ethoxy- N- [4- (2- methyl- 5- oxo- 4- propyltetrahydrofuran- 2- yl)- 1,3- thiazol- 2- yl]benzamide
Smiles: CCCC1CC(OC1=O)(C)c1csc(n1)NC(=O)c1ccc(cc1)OCC

STK685489
Synonyms: ethyl{3,5- dimethyl- 4- [(pyridin- 4- ylcarbonyl)amino]- 1H- pyrazol- 1- yl}acetate
Smiles: CCOC(=O)Cn1nc(c(c1C)NC(=O)c1ccncc1)C

STK685490
Synonyms: 3- [(3- chloropropanoyl)amino]- 2- hydroxybenzoicacid
Smiles: Oc1c(NC(=O)CCCl)cccc1C(=O)O

STK685491
Synonyms: 6- {[4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]methyl}- N,N- dimethyl- 1,3,5- triazine- 2,4- diamine
Smiles: Nc1nc(CN2CCN(CC2)Cc2ccc3c(c2)OCO3)nc(n1)N(C)C

STK779807
Synonyms: 1- [3- (9H- carbazol- 9- yl)propyl]- 3- phenylurea
Smiles: O=C(Nc1ccccc1)NCCCn1c2ccccc2c2c1cccc2

STK779808
Synonyms: N- (3,4- dihydro- 1H- isochromen- 1- ylmethyl)- 4- methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)NCC1OCCc2c1cccc2

STK685493
Synonyms: ethylN- {[4- (3- methylbutoxy)phenyl]carbonyl}tyrosinate
Smiles: CCOC(=O)C(NC(=O)c1ccc(cc1)OCCC(C)C)Cc1ccc(cc1)O

STK779809
Synonyms: 2- benzyl- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CC1(C)OCc2c(C1)c1c(s2)ncn2c1nc(n2)Cc1ccccc1

STK779811
Synonyms: 4- (3,4- dimethoxybenzyl)- 2H- 1,4- benzoxazine- 2,3(4H)- dione
Smiles: COc1cc(ccc1OC)Cn1c(=O)c(=O)oc2c1cccc2

STK685495
Synonyms: 6- amino- 5- bromo- 1- (4- fluorophenyl)pyrimidine- 2,4(1H,3H)- dione
Smiles: Nc1n(c2ccc(cc2)F)c(=O)[nH]c(=O)c1Br

STK685497
Synonyms: 6- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 3- methyl[1,2,4]triazolo[4,3- b]pyridazine
Smiles: Cc1nnc2n1nc(cc2)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK779816
Synonyms: ethyl5- (acetyloxy)- 1- butyl- 2- methyl- 1H- indole- 3- carboxylate
Smiles: CCCCn1c2ccc(cc2c(c1C)C(=O)OCC)OC(=O)C

STK779818
Synonyms: 4- amino- N- [2- (1H- imidazol- 4- yl)ethyl]- 1,2,5- oxadiazole- 3- carboxamide2- oxide
Smiles: O=C(c1c(N)no[n+]1[O-])NCCc1c[nH]cn1

STK685499
Synonyms: 2- phenyl- 2- (phenylsulfanyl)- 1H- indene- 1,3(2H)- dione
Smiles: O=C1c2ccccc2C(=O)C1(Sc1ccccc1)c1ccccc1

STK779820
Synonyms: 3- [4- (2- amino- 3,4- dihydro[1,3,5]triazino[1,2- a]benzimidazol- 4- yl)- 1H- pyrazol- 3- yl]phenol
Smiles: NC1=Nc2nc3c(n2C(N1)c1c[nH]nc1c1cccc(c1)O)cccc3

STK779821
Synonyms: 4- (5- fluoro- 1H- indol- 3- yl)- 3,4- dihydro[1,3,5]triazino[1,2- a]benzimidazol- 2- amine
Smiles: NC1=Nc2nc3c(n2C(N1)c1c[nH]c2c1cc(F)cc2)cccc3

STK685502
Synonyms: 4- (4,6- dimethoxy- 1- methyl- 1H- indol- 3- yl)- 3,4- dihydro[1,3,5]triazino[1,2- a]benzimidazol- 2- amine
Smiles: COc1cc(OC)cc2c1c(cn2C)C1NC(=Nc2n1c1ccccc1n2)N

STK685503
Synonyms: N- {[3- amino- 4- (trifluoromethyl)- 6,7,8,9- tetrahydro- 5H- cyclohepta[b]thieno[3,2- e]pyridin- 2- yl]carbonyl}glycine
Smiles: OC(=O)CNC(=O)c1sc2c(c1N)c(c1c(n2)CCCCC1)C(F)(F)F

STK779822
Synonyms: 4- chloro- N- [(8- methylimidazo[1,2- a]pyridin- 2- yl)methyl]aniline
Smiles: Clc1ccc(cc1)NCc1cn2c(n1)c(C)ccc2

STK685504
Synonyms: 3- fluoro- N- [(8- methylimidazo[1,2- a]pyridin- 2- yl)methyl]aniline
Smiles: Fc1cccc(c1)NCc1cn2c(n1)c(C)ccc2

STK685505
Synonyms: 3- oxo- 2- [1- (pyridin- 4- yl)ethyl]- 2,3- dihydro- 1H- isoindole- 4- carboxylicacid
Smiles: CC(N1Cc2c(C1=O)c(ccc2)C(=O)O)c1ccncc1

STK779823
Synonyms: 3- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- N- hydroxypropanamide
Smiles: ONC(=O)CCN1C(=O)c2c(C1=O)cccc2

STK779825
Synonyms: 2- [4- (2,5- dimethoxyphenyl)- 2,5- dioxo- 3,4,5,6,7,8- hexahydroquinolin- 1(2H)- yl]- 5,6,7,8- tetrahydro- 4H- cyclohepta[b]thiophene- 3- carbonitrile
Smiles: COc1ccc(c(c1)C1CC(=O)N(C2=C1C(=O)CCC2)c1sc2c(c1C#N)CCCCC2)OC

STK776307
Synonyms: N- [2- (1H- benzimidazol- 2- yl)ethyl]- 4- methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)NCCc1nc2c([nH]1)cccc2

STK776738
Synonyms: 1- (3- fluorobenzyl)- 2- methyl- 5- nitro- 1H- imidazole
Smiles: Fc1cccc(c1)Cn1c(C)ncc1[N+](=O)[O-]

STK777351
Synonyms: 3- (2- chlorobenzyl)- 3,6- dihydro- 7H- [1,2,3]triazolo[4,5- d]pyrimidin- 7- one
Smiles: Clc1ccccc1Cn1nnc2c1nc[nH]c2=O

STK777601
Synonyms: N- (3- chloro- 4- fluorophenyl)- 2- cyanoacetamide
Smiles: N#CCC(=O)Nc1ccc(c(c1)Cl)F

STK778928
Synonyms: 9- fluoro- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 5(6H)- one
Smiles: Fc1ccc2c(c1)c1nc3SCCn3c(=O)c1[nH]2

STK779326
Synonyms: 3- oxo- 3- (thiophen- 2- yl)propanenitrile
Smiles: N#CCC(=O)c1cccs1

STL364121
Synonyms: 4- phenyl- N- [3- (trifluoromethyl)phenyl]phthalazin- 1- amine
Smiles: FC(c1cccc(c1)Nc1nnc(c2c1cccc2)c1ccccc1)(F)F

STK779826
Synonyms: 2,4- dichloro- 5- (cyclopropylsulfamoyl)- N- [2- (tricyclo[3.3.1.1~3,7~]dec- 1- yloxy)ethyl]benzamide
Smiles: O=C(c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1)NCCOC12CC3CC(C2)CC(C1)C3

STK779827
Synonyms: 2- (9- fluoro- 5- oxo- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 6(5H)- yl)- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Cn1c2ccc(cc2c2c1c(=O)n1CCSc1n2)F)Nc1cccc(c1)C(F)(F)F

STK779829
Synonyms: 4- (4- chlorophenyl)- 1- [2- (trifluoromethyl)phenyl]- 1H- 1,2,3- triazol- 5- amine
Smiles: Clc1ccc(cc1)c1nnn(c1N)c1ccccc1C(F)(F)F

STK779830
Synonyms: 1- (2- fluorophenyl)- 4- (4- fluorophenyl)- 1H- 1,2,3- triazol- 5- amine
Smiles: Fc1ccc(cc1)c1nnn(c1N)c1ccccc1F

STK685508
Synonyms: 1- (3- chlorophenyl)- 4- [(4- methoxyphenyl)sulfonyl]- 1H- 1,2,3- triazol- 5- amine
Smiles: COc1ccc(cc1)S(=O)(=O)c1nnn(c1N)c1cccc(c1)Cl

STK779834
Synonyms: 4- (1H- benzimidazol- 2- yl)- 1- [3- (trifluoromethyl)phenyl]- 1H- 1,2,3- triazol- 5- amine
Smiles: Nc1c(nnn1c1cccc(c1)C(F)(F)F)c1nc2c([nH]1)cccc2

STK685509
Synonyms: 4- (1H- benzimidazol- 2- yl)- 1- (5- chloro- 2- methoxyphenyl)- 1H- 1,2,3- triazol- 5- amine
Smiles: COc1ccc(cc1n1nnc(c1N)c1nc2c([nH]1)cccc2)Cl

STK779835
Synonyms: 4- (1H- benzimidazol- 2- yl)- 1- (2- chlorophenyl)- 1H- 1,2,3- triazol- 5- amine
Smiles: Clc1ccccc1n1nnc(c1N)c1nc2c([nH]1)cccc2

STK779836
Synonyms: 5- amino- N- (2- fluorophenyl)- 1- (4- methoxyphenyl)- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: COc1ccc(cc1)n1nnc(c1N)C(=O)Nc1ccccc1F

STK685510
Synonyms: 7- methoxy- 1,3,3a,12a- tetrahydrothieno[3'',4'':4',5'][1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 11(10H)- one2,2- dioxide
Smiles: COc1ccc2c(c1)c1nc3SC4C(n3c(=O)c1[nH]2)CS(=O)(=O)C4

STK779839
Synonyms: 6H- pyrido[3',2':4,5][1,3]thiazolo[2,3- b]quinazolin- 6- one
Smiles: O=c1c2ccccc2nc2n1c1cccnc1s2

STK779843
Synonyms: N- (3- fluorophenyl)- 3- (4- hydroxy- 4,5,5- trimethyl- 2- oxo- 1,3- oxazolidin- 3- yl)propanamide
Smiles: O=C(Nc1cccc(c1)F)CCN1C(=O)OC(C1(C)O)(C)C

STK779844
Synonyms: 3- (5- ethyl- 4- hydroxy- 4,5- dimethyl- 2- oxo- 1,3- oxazolidin- 3- yl)- N- (3- fluorophenyl)propanamide
Smiles: CCC1(C)OC(=O)N(C1(C)O)CCC(=O)Nc1cccc(c1)F

STK779847
Synonyms: 5- {(1Z)- 1- [2- (1,3- benzothiazol- 2- yl)hydrazinylidene]ethyl}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)C(C(=O)N1)/C(=N\Nc1nc2c(s1)cccc2)/C

STK779848
Synonyms: 5- [(1,3- benzodioxol- 5- ylmethyl)amino]- 1- benzyl- N- phenyl- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: O=C(c1nnn(c1NCc1ccc2c(c1)OCO2)Cc1ccccc1)Nc1ccccc1

STK779850
Synonyms: 10- methoxy- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 6(7H)- one
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1[nH]2

STK779855
Synonyms: 8- (2- hydroxyethyl)- 1,3,6- trimethyl- 7- phenyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: OCCn1c2nc3c(n2c(c1c1ccccc1)C)c(=O)n(c(=O)n3C)C

STK779858
Synonyms: 4- (5- fluoro- 1- methyl- 1H- indol- 3- yl)- 3,4- dihydro[1,3,5]triazino[1,2- a]benzimidazol- 2- amine
Smiles: NC1=Nc2nc3c(n2C(N1)c1cn(c2c1cc(F)cc2)C)cccc3

STK779859
Synonyms: 1,1'- (5- chloro- 1,3,7- triazabicyclo[3.3.1]nonane- 3,7- diyl)diethanone
Smiles: CC(=O)N1CN2CN(CC(C1)(C2)Cl)C(=O)C

STK685519
Synonyms: 2- ({5- [(E)- 2- (3,4- dimethoxyphenyl)ethenyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N'- [(4- methoxyphenyl)acetyl]acetohydrazide
Smiles: COc1ccc(cc1)CC(=O)NNC(=O)CSc1nnc([nH]1)/C=C/c1ccc(c(c1)OC)OC

STK779860
Synonyms: 3,5- dimethoxy- N- {[(1S,5R)- 8- oxo- 1,5,6,8- tetrahydro- 2H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 3(4H)- yl]carbonothioyl}benzamide
Smiles: COc1cc(OC)cc(c1)C(=O)NC(=S)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

STK685520
Synonyms: 2- (2,5- dioxohexahydroimidazo[4,5- d]imidazol- 1(2H)- yl)butanoicacid
Smiles: CCC(N1C(=O)NC2C1NC(=O)N2)C(=O)O

STK685522
Synonyms: (triphenyl- lambda~5~- phosphanylidene)phosphoramidicacid
Smiles: OP(=O)(N=P(c1ccccc1)(c1ccccc1)c1ccccc1)O

STK685523
Synonyms: 3- {[(4- bromophenyl)sulfonyl]amino}- 3- (4- propoxyphenyl)propanoicacid
Smiles: CCCOc1ccc(cc1)C(NS(=O)(=O)c1ccc(cc1)Br)CC(=O)O

STK779862
Synonyms: ethyl4- [3- (4- ethoxyphenyl)- 4- (3- fluorophenyl)- 6- oxo- 4,6- dihydropyrrolo[3,4- c]pyrazol- 5(1H)- yl]benzoate
Smiles: CCOc1ccc(cc1)c1n[nH]c2c1C(c1cccc(c1)F)N(C2=O)c1ccc(cc1)C(=O)OCC

STK779863
Synonyms: ethyl4- [4- (2- methoxyphenyl)- 6- oxo- 3- (thiophen- 2- yl)- 4,6- dihydropyrrolo[3,4- c]pyrazol- 5(1H)- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(c2ccccc2OC)c2c(C1=O)[nH]nc2c1cccs1

STK685525
Synonyms: 3- [4- (benzyloxy)phenyl]- 3- [(thiophen- 2- ylcarbonyl)amino]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1)OCc1ccccc1)NC(=O)c1cccs1

STK779867
Synonyms: 4- [1- (2- chloro- 6- fluorobenzyl)- 1H- benzimidazol- 2- yl]- 1- (5- chloro- 2- methoxyphenyl)pyrrolidin- 2- one
Smiles: COc1ccc(cc1N1CC(CC1=O)c1nc2c(n1Cc1c(F)cccc1Cl)cccc2)Cl

STK779871
Synonyms: methyl6- amino- 5- cyano- 2- methyl- 4- [4- (morpholin- 4- ylmethyl)thiophen- 2- yl]- 4H- pyran- 3- carboxylate
Smiles: COC(=O)C1=C(C)OC(=C(C1c1scc(c1)CN1CCOCC1)C#N)N

STK779873
Synonyms: 2- amino- 7,7- dimethyl- 1- (4- methylphenyl)- 4- [4- (morpholin- 4- ylmethyl)thiophen- 2- yl]- 5- oxo- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(N)N(c2ccc(cc2)C)C2=C(C1c1scc(c1)CN1CCOCC1)C(=O)CC(C2)(C)C

STK685529
Synonyms: 4- methylcyclohexyl4- {[3- ethoxy- 1- (4- methoxyphenyl)- 3- oxopropyl]amino}- 4- oxobutanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)OC)NC(=O)CCC(=O)OC1CCC(CC1)C

STK685531
Synonyms: 2- [(3- chlorophenyl)amino][1,3]thiazolo[4,5- b]pyridine- 5,7- diol
Smiles: Clc1cccc(c1)Nc1nc2c(s1)c(O)cc(n2)O

STK779883
Synonyms: 4- (difluoromethoxy)- N- [3- (1,2- oxazol- 5- yl)phenyl]benzamide
Smiles: FC(Oc1ccc(cc1)C(=O)Nc1cccc(c1)c1ccno1)F

STK685532
Synonyms: 4- bromo- N- (2- ethoxyphenyl)- 1- ethyl- 1H- pyrazole- 5- carboxamide
Smiles: CCOc1ccccc1NC(=O)c1c(Br)cnn1CC

STK779888
Synonyms: ethyl3- (4- methylphenyl)- 3- {[(2- oxo- 2,3- dihydro- 1,3- benzothiazol- 6- yl)sulfonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NS(=O)(=O)c1ccc2c(c1)sc(=O)[nH]2

STK779889
Synonyms: ethyl3- (3- nitrophenyl)- 3- {[(2- oxo- 1,3- benzothiazol- 3(2H)- yl)acetyl]amino}propanoate
Smiles: CCOC(=O)CC(c1cccc(c1)[N+](=O)[O-])NC(=O)Cn1c(=O)sc2c1cccc2

STK779890
Synonyms: methyl5- fluoro- 3- {[(2- oxo- 1,3- benzothiazol- 3(2H)- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)Cn1c(=O)sc3c1cccc3)cc(cc2)F

STK779891
Synonyms: 2- (2- oxo- 1,3- benzothiazol- 3(2H)- yl)- N- (quinolin- 3- yl)acetamide
Smiles: O=C(Cn1c(=O)sc2c1cccc2)Nc1cnc2c(c1)cccc2

STK779892
Synonyms: 3- amino- 4- hydroxy- 4,5- dimethyl- 5- (2- methyl- 2- phenylpropyl)- 1,3- oxazolidin- 2- one
Smiles: NN1C(=O)OC(C1(C)O)(C)CC(c1ccccc1)(C)C

STK779895
Synonyms: 1,3a,5,5,9b- pentamethyl- 3a,4,5,9b- tetrahydronaphtho[1,2- d][1,3]oxazol- 2(1H)- one
Smiles: O=C1OC2(C(N1C)(C)c1ccccc1C(C2)(C)C)C

STK779899
Synonyms: 3- {[4- (4- ethylphenyl)piperazin- 1- yl]carbonyl}- 6- nitro- 2H- chromen- 2- one
Smiles: CCc1ccc(cc1)N1CCN(CC1)C(=O)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

STK685540
Synonyms: N- (4- {1- [2- (2,3- dihydro- 1H- indol- 1- yl)- 2- oxoethyl]- 3'- (2- methylpropyl)- 2,4',6'- trioxo- 1,2,2',3',3a',4',6',6a'- octahydro- 5'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 5'- yl}phenyl)acetamide
Smiles: CC(CC1NC2(C3C1C(=O)N(C3=O)c1ccc(cc1)NC(=O)C)C(=O)N(c1c2cccc1)CC(=O)N1CCc2c1cccc2)C

STK685542
Synonyms: 5,7- dichloro- 2- methylquinolin- 8- ylpyrrolidine- 1- carboxylate
Smiles: O=C(N1CCCC1)Oc1c(Cl)cc(c2c1nc(C)cc2)Cl

STK685543
Synonyms: 5,7- dichloro- 2- methylquinolin- 8- ylmorpholine- 4- carboxylate
Smiles: O=C(N1CCOCC1)Oc1c(Cl)cc(c2c1nc(C)cc2)Cl

STK779904
Synonyms: 2,4- dichloro- N- [2- (5- fluoro- 2- methyl- 1H- indol- 3- yl)ethyl]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)NCCc1c(C)[nH]c2c1cc(F)cc2

STK779905
Synonyms: 3- benzyl- 5- methyl- 3H- [1,2,3]triazolo[4,5- d]pyrimidin- 7- ol
Smiles: Cc1nc(O)c2c(n1)n(nn2)Cc1ccccc1

STK779906
Synonyms: 1- {4- [3- (1H- benzimidazol- 1- yl)- 2- hydroxypropoxy]- 3- methoxyphenyl}ethanone
Smiles: COc1cc(ccc1OCC(Cn1cnc2c1cccc2)O)C(=O)C

STK779907
Synonyms: 1- {4- [2- hydroxy- 3- (2- methyl- 1H- benzimidazol- 1- yl)propoxy]- 3- methoxyphenyl}ethanone
Smiles: COc1cc(ccc1OCC(Cn1c(C)nc2c1cccc2)O)C(=O)C

STK779908
Synonyms: N- (4- {3- [4- (dimethylsulfamoyl)piperazin- 1- yl]- 2- hydroxypropoxy}phenyl)acetamide
Smiles: OC(CN1CCN(CC1)S(=O)(=O)N(C)C)COc1ccc(cc1)NC(=O)C

STK685547
Synonyms: N- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)morpholine- 4- sulfonamide
Smiles: Cc1c(NS(=O)(=O)N2CCOCC2)c(=O)n(n1C)c1ccccc1

STK779909
Synonyms: N- (quinolin- 3- yl)piperidine- 1- sulfonamide
Smiles: O=S(=O)(N1CCCCC1)Nc1cnc2c(c1)cccc2

STK779917
Synonyms: N- [2- (trifluoromethyl)- 1H- benzimidazol- 4- yl]thiophene- 2- carboxamide
Smiles: O=C(c1cccs1)Nc1cccc2c1nc([nH]2)C(F)(F)F

STK779918
Synonyms: N- [2- (trifluoromethyl)- 1H- benzimidazol- 4- yl]furan- 2- carboxamide
Smiles: O=C(c1ccco1)Nc1cccc2c1nc([nH]2)C(F)(F)F

STK779920
Synonyms: 4- [(4- methoxyphenyl)amino]- 6- methyl- 3- propanoyl- 2H- pyran- 2- one
Smiles: CCC(=O)c1c(Nc2ccc(cc2)OC)cc(oc1=O)C

STK779921
Synonyms: N- methyl- N- [3- nitro- 6- (prop- 2- en- 1- yl)dibenzo[b,f]oxepin- 1- yl]acetamide
Smiles: C=CCc1cccc2c1Oc1cc(cc(c1C=C2)N(C(=O)C)C)[N+](=O)[O-]

STK779924
Synonyms: 3- {[4- (2- fluorophenyl)piperazin- 1- yl]carbonyl}- 6- nitro- 2H- chromen- 2- one
Smiles: O=C(c1cc2cc(ccc2oc1=O)[N+](=O)[O-])N1CCN(CC1)c1ccccc1F

STK779925
Synonyms: 2- (2- oxo- 1,3- benzothiazol- 3(2H)- yl)- N- [4- (1,3- thiazol- 2- ylsulfamoyl)phenyl]acetamide
Smiles: O=C(Cn1c(=O)sc2c1cccc2)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1

STK779926
Synonyms: 1- (1H- benzimidazol- 4- yl)- 2,6- dimethyl- 5- phenylpyrimidin- 4(1H)- one
Smiles: Cc1nc(=O)c(c(n1c1cccc2c1nc[nH]2)C)c1ccccc1

STK779929
Synonyms: 4- nitro- 7- (prop- 2- en- 1- yl)- 2,11- dihydro[1]benzoxepino[4,3,2- cd]indole
Smiles: C=CCc1cccc2c1Oc1cc(cc3c1c(C2)c[nH]3)[N+](=O)[O-]

STK779930
Synonyms: (1R,2R,5S)- 2- {4- methyl- 3- [(2- methyl- 5- nitro- 1H- imidazol- 1- yl)methyl]- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 1- yl}- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: O=C1C[C@H]([C@H]2O[C@@H]1OC2)n1nc(n(c1=S)C)Cn1c(C)ncc1[N+](=O)[O-]

STK685550
Synonyms: 4- (4,6- diethyl- 2,5- dioxohexahydroimidazo[4,5- d]imidazol- 1(2H)- yl)butanoicacid
Smiles: CCN1C2N(CCCC(=O)O)C(=O)NC2N(C1=O)CC

STK779931
Synonyms: 1- amino- 3a,5,5,9b- tetramethyl- 3a,4,5,9b- tetrahydronaphtho[1,2- d][1,3]oxazol- 2(1H)- one
Smiles: O=C1OC2(C(N1N)(C)c1ccccc1C(C2)(C)C)C

STK685551
Synonyms: 2- [1- amino- 2- (3,4- diethoxyphenyl)ethylidene]cyclohexane- 1,3- dione
Smiles: CCOc1cc(ccc1OCC)CC(=C1C(=O)CCCC1=O)N

STK779934
Synonyms: 4- amino- 6- methyl- 3- propanoyl- 2H- pyran- 2- one
Smiles: CCC(=O)c1c(N)cc(oc1=O)C

STK685552
Synonyms: 6- methyl- 4- (methylamino)- 3- propanoyl- 2H- pyran- 2- one
Smiles: CCC(=O)c1c(NC)cc(oc1=O)C

STK779936
Synonyms: 4- [(2- hydroxyethyl)amino]- 6- methyl- 3- propanoyl- 2H- pyran- 2- one
Smiles: OCCNc1cc(C)oc(=O)c1C(=O)CC

STK779938
Synonyms: 6- methyl- 3- propanoyl- 4- (prop- 2- en- 1- ylamino)- 2H- pyran- 2- one
Smiles: C=CCNc1cc(C)oc(=O)c1C(=O)CC

STK779939
Synonyms: 6- methyl- 3- propanoyl- 4- (pyrrolidin- 1- yl)- 2H- pyran- 2- one
Smiles: CCC(=O)c1c(=O)oc(cc1N1CCCC1)C

STK779940
Synonyms: 4- (benzylamino)- 6- methyl- 3- propanoyl- 2H- pyran- 2- one
Smiles: CCC(=O)c1c(NCc2ccccc2)cc(oc1=O)C

STK779941
Synonyms: 4- [(2- methoxyphenyl)amino]- 6- methyl- 3- propanoyl- 2H- pyran- 2- one
Smiles: CCC(=O)c1c(cc(oc1=O)C)Nc1ccccc1OC

STK779942
Synonyms: 4- [(3- methoxyphenyl)amino]- 6- methyl- 3- propanoyl- 2H- pyran- 2- one
Smiles: COc1cccc(c1)Nc1cc(C)oc(=O)c1C(=O)CC

STK685554
Synonyms: ethyl1- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 6,8- difluoro- 4- oxo- 7- (pyrrolidin- 1- yl)- 1,4- dihydroquinoline- 3- carboxylate
Smiles: CCOC(=O)c1cn(c2c(c1=O)cc(c(c2F)N1CCCC1)F)c1c(C)n(n(c1=O)c1ccccc1)C

STK685555
Synonyms: 7- (cyclohexylamino)- 1- ethyl- 6- fluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(NC1CCCCC1)c(c2)F

STK685556
Synonyms: 6,8- difluoro- 4- oxo- 7- (phenylamino)- 1- (1,3- thiazol- 2- yl)- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: Fc1cc2c(c(c1Nc1ccccc1)F)n(cc(c2=O)C(=O)O)c1nccs1

STK779946
Synonyms: 7,8- difluoro- N- phenylphenazin- 2- amine
Smiles: Fc1cc2nc3ccc(cc3nc2cc1F)Nc1ccccc1

STK685558
Synonyms: 4- fluoro- 5- (morpholin- 4- yl)benzene- 1,2- diamine
Smiles: Fc1cc(N)c(cc1N1CCOCC1)N

STK779948
Synonyms: N- cyclohexyl- 2- (2,5- dioxohexahydroimidazo[4,5- d]imidazol- 1(2H)- yl)acetamide
Smiles: O=C(CN1C(=O)NC2C1NC(=O)N2)NC1CCCCC1

STK779958
Synonyms: 2- (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)- N- hydroxy- 3- methylbutanamide
Smiles: ONC(=O)C(N1C(=O)c2c(C1=O)cccc2)C(C)C

STK685561
Synonyms: N'- {(E)- [3- (4- fluorophenyl)- 1H- pyrazol- 4- yl]methylidene}- 4- hydroxybenzohydrazide
Smiles: Oc1ccc(cc1)C(=O)N/N=C/c1c[nH]nc1c1ccc(cc1)F

STK779970
Synonyms: 2- {[2- oxo- 2- (2- oxoimidazolidin- 1- yl)ethyl]sulfanyl}- 6,7,8,9- tetrahydro- 5H- cyclohepta[b]pyridine- 3- carbonitrile
Smiles: N#Cc1cc2CCCCCc2nc1SCC(=O)N1CCNC1=O

STK779972
Synonyms: 2,3- dimethyl- 6- phenylpyridine
Smiles: Cc1ccc(nc1C)c1ccccc1

STK779973
Synonyms: 6- nitro- 1,2,3,4- tetrahydronaphthalene
Smiles: [O-][N+](=O)c1ccc2c(c1)CCCC2

STK779974
Synonyms: N- (2,1,3- benzoxadiazol- 4- yl)- 2- fluorobenzamide
Smiles: O=C(c1ccccc1F)Nc1cccc2c1non2

STK779975
Synonyms: 4- [4- (methylsulfanyl)phenyl]- 1- [3- (trifluoromethyl)phenyl]- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: CSc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)C(F)(F)F

STK779987
Synonyms: 4- bromo- 2- [(1H- indazol- 5- ylamino)methyl]phenol
Smiles: Brc1ccc(c(c1)CNc1ccc2c(c1)cn[nH]2)O

STK685567
Synonyms: 2,4- dichloro- 6- [(1H- indazol- 5- ylamino)methyl]phenol
Smiles: Clc1cc(CNc2ccc3c(c2)cn[nH]3)c(c(c1)Cl)O

STK779988
Synonyms: 6- methyl- 3- propanoyl- 4- (propylamino)- 2H- pyran- 2- one
Smiles: CCCNc1cc(C)oc(=O)c1C(=O)CC

STK685576
Synonyms: 6- fluoro- 2- (2,4,5- trichlorophenyl)- 1,2- benzothiazol- 3(2H)- one
Smiles: Fc1ccc2c(c1)sn(c2=O)c1cc(Cl)c(cc1Cl)Cl

STK779993
Synonyms: 2- (3- chloro- 2- methylphenyl)- 6- nitro- 4- (2,2,2- trifluoroethoxy)- 1,2- benzothiazol- 3(2H)- one
Smiles: [O-][N+](=O)c1cc(OCC(F)(F)F)c2c(c1)sn(c2=O)c1cccc(c1C)Cl

STK685577
Synonyms: 2- (benzylamino)phenol
Smiles: Oc1ccccc1NCc1ccccc1

STK779995
Synonyms: N- (1,8- dioxo- 1,3,4,8,9,9a- hexahydro- 2H- pyrazino[1,2- c]pyrimidin- 6- yl)- 4- fluorobenzamide
Smiles: O=C1NCCN2C1CC(=O)N=C2NC(=O)c1ccc(cc1)F

STK779996
Synonyms: N- (1,8- dioxo- 1,3,4,8,9,9a- hexahydro- 2H- pyrazino[1,2- c]pyrimidin- 6- yl)- 4- methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)NC1=NC(=O)CC2N1CCNC2=O

STK779997
Synonyms: 2- amino- 1- (3- fluorophenyl)- 5- oxo- 4,5- dihydro- 1H- pyrrole- 3- carbonitrile
Smiles: N#CC1=C(N)N(C(=O)C1)c1cccc(c1)F

STK685578
Synonyms: furan- 2- yl{4- [(2- methyl- 1,3- benzoxazol- 7- yl)carbonyl]piperazin- 1- yl}methanone
Smiles: Cc1nc2c(o1)c(ccc2)C(=O)N1CCN(CC1)C(=O)c1ccco1

STK780012
Synonyms: N- (3- methylphenyl)- 2- oxo- 1- oxaspiro[4.4]nonane- 4- carboxamide
Smiles: O=C1CC(C2(O1)CCCC2)C(=O)Nc1cccc(c1)C

STK780014
Synonyms: 2- oxo- 1- oxaspiro[4.4]nonane- 4- carboxamide
Smiles: O=C1CC(C2(O1)CCCC2)C(=O)N

STK780015
Synonyms: (2E)- 4- (2- chlorophenyl)- 2- (furan- 2- ylmethylidene)- 4- oxo- N- [(4- oxo- 3,4- dihydrophthalazin- 1- yl)methyl]butanamide
Smiles: O=C(/C(=C/c1ccco1)/CC(=O)c1ccccc1Cl)NCc1n[nH]c(=O)c2c1cccc2

STK685581
Synonyms: 4- bromo- N- [(1Z)- 1- (furan- 2- yl)- 3- oxo- 3- {[(4- oxo- 3,4- dihydrophthalazin- 1- yl)methyl]amino}prop- 1- en- 2- yl]benzamide
Smiles: Brc1ccc(cc1)C(=O)N/C(=C\c1ccco1)/C(=O)NCc1n[nH]c(=O)c2c1cccc2

STK780016
Synonyms: 10- benzyl- 3- nitrodibenzo[b,f][1,4]oxazepin- 11(10H)- one
Smiles: O=C1c2ccc(cc2Oc2c(N1Cc1ccccc1)cccc2)[N+](=O)[O-]

STK780018
Synonyms: 10- (4- methoxybenzyl)- 3- nitrodibenzo[b,f][1,4]oxazepin- 11(10H)- one
Smiles: COc1ccc(cc1)CN1C(=O)c2ccc(cc2Oc2c1cccc2)[N+](=O)[O-]

STK780020
Synonyms: N- [(1Z)- 3- {[2- (1H- benzimidazol- 2- yl)ethyl]amino}- 1- (4- methoxyphenyl)- 3- oxoprop- 1- en- 2- yl]- 3- nitrobenzamide
Smiles: COc1ccc(cc1)/C=C(/C(=O)NCCc1nc2c([nH]1)cccc2)\NC(=O)c1cccc(c1)[N+](=O)[O-]

STK685582
Synonyms: 4- (4- {[(5- fluoro- 2- nitrophenoxy)acetyl]amino}- 1H- pyrazol- 1- yl)butanoicacid
Smiles: O=C(Nc1cnn(c1)CCCC(=O)O)COc1cc(F)ccc1[N+](=O)[O-]

STK685584
Synonyms: 4- (4- {[(3,5- dimethoxyphenyl)carbonyl]amino}- 1H- pyrazol- 1- yl)butanoicacid
Smiles: COc1cc(OC)cc(c1)C(=O)Nc1cnn(c1)CCCC(=O)O

STK685585
Synonyms: 4- (4- {[(3,4,5- trimethoxyphenyl)carbonyl]amino}- 1H- pyrazol- 1- yl)butanoicacid
Smiles: COc1cc(cc(c1OC)OC)C(=O)Nc1cnn(c1)CCCC(=O)O

STK780037
Synonyms: N- (4- bromo- 2- fluorophenyl)- 2- (4- bromo- 5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Br)[N+](=O)[O-])Nc1ccc(cc1F)Br

STK780042
Synonyms: N- [4- (cyanomethyl)phenyl]- 4- (3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)butanamide
Smiles: N#CCc1ccc(cc1)NC(=O)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK780048
Synonyms: 3- methoxy- N- [1- (propan- 2- yl)- 1H- pyrazol- 4- yl]benzamide
Smiles: COc1cccc(c1)C(=O)Nc1cnn(c1)C(C)C

STK780051
Synonyms: N- (1- benzyl- 1H- pyrazol- 3- yl)- 2- (4- iodo- 3,5- dimethyl- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)I)C)Nc1ccn(n1)Cc1ccccc1

STK685590
Synonyms: 4- (4- {[(3,4- dimethoxyphenyl)carbonyl]amino}- 1H- pyrazol- 1- yl)butanoicacid
Smiles: COc1cc(ccc1OC)C(=O)Nc1cnn(c1)CCCC(=O)O

STK685591
Synonyms: 4- {4- [(diphenylacetyl)amino]- 1H- pyrazol- 1- yl}butanoicacid
Smiles: OC(=O)CCCn1ncc(c1)NC(=O)C(c1ccccc1)c1ccccc1

STK780062
Synonyms: 2- (4- bromo- 5- methyl- 3- nitro- 1H- pyrazol- 1- yl)- 1- (3,5- dimethyl- 1H- pyrazol- 1- yl)ethanone
Smiles: Cc1nn(c(c1)C)C(=O)Cn1nc(c(c1C)Br)[N+](=O)[O-]

STK780063
Synonyms: 4- {[2- (3,4- dimethoxyphenyl)ethyl]amino}- 6- methyl- 3- propanoyl- 2H- pyran- 2- one
Smiles: CCC(=O)c1c(NCCc2ccc(c(c2)OC)OC)cc(oc1=O)C

STK780065
Synonyms: 3- butanoyl- 4- [(2- hydroxyphenyl)amino]- 6- methyl- 2H- pyran- 2- one
Smiles: CCCC(=O)c1c(cc(oc1=O)C)Nc1ccccc1O

STK685596
Synonyms: N- [2- (1H- benzimidazol- 2- yl)ethyl]- 2- (3,4- dimethoxyphenyl)acetamide
Smiles: COc1cc(ccc1OC)CC(=O)NCCc1nc2c([nH]1)cccc2

STK685598
Synonyms: 1'- amino- 4'H- spiro[cyclopentane- 1,3'- pyrido[1,2- a]benzimidazole]- 2',4'- dicarbonitrile
Smiles: N#CC1c2nc3c(n2C(=C(C21CCCC2)C#N)N)cccc3

STK780069
Synonyms: N- [1- (4- chlorophenyl)ethyl]- 3- (4- fluorophenyl)- 3- (furan- 2- yl)propan- 1- amine
Smiles: Fc1ccc(cc1)C(c1ccco1)CCNC(c1ccc(cc1)Cl)C

STK780070
Synonyms: N- [(2,2- dimethyltetrahydro- 2H- pyran- 4- yl)methyl]- 3- (4- fluorophenyl)- 3- (furan- 2- yl)propan- 1- amine
Smiles: Fc1ccc(cc1)C(c1ccco1)CCNCC1CCOC(C1)(C)C

STK685599
Synonyms: 1- (2,2- dimethyltetrahydro- 2H- pyran- 4- yl)- N- (furan- 2- ylmethyl)methanamine
Smiles: CC1(C)OCCC(C1)CNCc1ccco1

STK685603
Synonyms: 2,4- difluorophenyl({4- [1- phenyl- 3- (trifluoromethyl)- 1H- pyrazol- 5- yl]phenyl}carbamoyl)sulfamate
Smiles: O=C(NS(=O)(=O)Oc1ccc(cc1F)F)Nc1ccc(cc1)c1cc(nn1c1ccccc1)C(F)(F)F

STK685605
Synonyms: methyl2- (1,3- benzothiazol- 2- ylamino)- 5- (methoxymethyl)pyrimidine- 4- carboxylate
Smiles: COCc1cnc(nc1C(=O)OC)Nc1nc2c(s1)cccc2

STK685608
Synonyms: 2- (piperidin- 2- yl)acetamide
Smiles: NC(=O)CC1CCCCN1

STK780081
Synonyms: 4- bromo- N- (1H- indazol- 6- yl)benzenesulfonamide
Smiles: Brc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)[nH]nc2

STK780082
Synonyms: N- (1H- indazol- 6- yl)- 4- propoxynaphthalene- 1- sulfonamide
Smiles: CCCOc1ccc(c2c1cccc2)S(=O)(=O)Nc1ccc2c(c1)[nH]nc2

STK780084
Synonyms: 5- bromo- N- (1H- indazol- 7- yl)- 2- methoxybenzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)Nc1cccc2c1[nH]nc2)Br

STK685611
Synonyms: 5- tert- butyl- 2- ethoxy- N- (1H- indazol- 7- yl)benzenesulfonamide
Smiles: CCOc1ccc(cc1S(=O)(=O)Nc1cccc2c1[nH]nc2)C(C)(C)C

STK780085
Synonyms: 5- chloro- 2- ethoxy- N- (1H- indazol- 7- yl)- 4- methylbenzenesulfonamide
Smiles: CCOc1cc(C)c(cc1S(=O)(=O)Nc1cccc2c1[nH]nc2)Cl

STK780087
Synonyms: 2- amino- 1- (4- fluorophenyl)- 5- oxo- 4,5- dihydro- 1H- pyrrole- 3- carbonitrile
Smiles: N#CC1=C(N)N(C(=O)C1)c1ccc(cc1)F

STK685613
Synonyms: 2- amino- 5- oxo- 1- [4- (trifluoromethyl)phenyl]- 4,5- dihydro- 1H- pyrrole- 3- carbonitrile
Smiles: N#CC1=C(N)N(C(=O)C1)c1ccc(cc1)C(F)(F)F

STK780090
Synonyms: N- (3- methoxypyrazin- 2- yl)- 4- [5- oxo- 4- (propan- 2- yl)- 2- thioxoimidazolidin- 1- yl]benzenesulfonamide
Smiles: COc1nccnc1NS(=O)(=O)c1ccc(cc1)N1C(=S)NC(C1=O)C(C)C

STK685614
Synonyms: 8,13,15a,16- tetrahydropyrazino[1,2- b:4,5- b']diisoquinoline- 7,15(5H,7aH)- dione
Smiles: O=C1N2Cc3ccccc3CC2C(=O)N2C1Cc1ccccc1C2

STK780093
Synonyms: 4- {4- [(3,5- dichloropyridin- 2- yl)oxy]phenoxy}- 5- nitrobenzene- 1,2- dicarbonitrile
Smiles: N#Cc1cc(Oc2ccc(cc2)Oc2ncc(cc2Cl)Cl)c(cc1C#N)[N+](=O)[O-]

STK780094
Synonyms: N- [3- chloro- 5- (trifluoromethyl)pyridin- 2- yl]- 3- (2,3- dihydro- 1,4- benzodioxin- 2- yl)propanamide
Smiles: O=C(Nc1ncc(cc1Cl)C(F)(F)F)CCC1COc2c(O1)cccc2

STK780095
Synonyms: 3- (2,3- dihydro- 1,4- benzodioxin- 2- yl)- N- (5- methyl- 1,2- oxazol- 3- yl)propanamide
Smiles: O=C(Nc1noc(c1)C)CCC1COc2c(O1)cccc2

STK780097
Synonyms: 4- fluoro- N- [(7- methylimidazo[1,2- a]pyridin- 2- yl)methyl]aniline
Smiles: Fc1ccc(cc1)NCc1cn2c(n1)cc(cc2)C

STK685617
Synonyms: methyl3- oxo- 2- [3- (trifluoromethyl)phenyl]- 2,3- dihydro- 1H- isoindole- 4- carboxylate
Smiles: COC(=O)c1cccc2c1C(=O)N(C2)c1cccc(c1)C(F)(F)F

STK685619
Synonyms: N- (6- methylpyridin- 2- yl)quinoxaline- 6- carboxamide
Smiles: Cc1cccc(n1)NC(=O)c1ccc2c(c1)nccn2

STK780099
Synonyms: N- [2- chloro- 5- (trifluoromethyl)phenyl]quinoxaline- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)nccn2)Nc1cc(ccc1Cl)C(F)(F)F

STK685621
Synonyms: 11,11- dimethyl- 3,4- dihydro- 1,4- methanophenazine- 1(2H)- carboxylicacid
Smiles: OC(=O)C12CCC(C2(C)C)c2c1nc1ccccc1n2

STK685622
Synonyms: 1,11- bis(bromomethyl)- 7,8- dichloro- 11- methyl- 1,2,3,4- tetrahydro- 1,4- methanophenazine
Smiles: BrCC1(C)C2CCC1(CBr)c1c2nc2c(n1)cc(c(c2)Cl)Cl

STK685623
Synonyms: ethyl1- phenyl- 4,5- dihydro- 1H- furo[2,3- g]indazole- 3- carboxylate
Smiles: CCOC(=O)c1nn(c2c1CCc1c2cco1)c1ccccc1

STK780100
Synonyms: methyl1,5,5- trimethyl- 4,5- dihydrofuro[3,2- a]phenazine- 2- carboxylate
Smiles: COC(=O)c1oc2c(c1C)c1nc3ccccc3nc1C(C2)(C)C

STK780103
Synonyms: N- (2,5- dimethoxyphenyl)- 2- (4,6- dimethyl- 1- benzofuran- 3- yl)acetamide
Smiles: COc1ccc(cc1NC(=O)Cc1coc2c1c(C)cc(c2)C)OC

STK780106
Synonyms: 1- (dimethylamino)- 4- (4- ethylphenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: CCc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CCC2)N(C)C

STK780110
Synonyms: 1,2- bis(2,5- dimethylthiophen- 3- yl)- 2- hydroxyethanone
Smiles: Cc1sc(c(c1)C(C(=O)c1cc(sc1C)C)O)C

STK780112
Synonyms: 4,7- diamino- 2- [(4- chlorobenzyl)sulfanyl]- 5- (pyridin- 3- yl)- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccnc1)c(N)nc(n2)SCc1ccc(cc1)Cl

STK780113
Synonyms: 4,7- diamino- 5- (3- fluorophenyl)- 2- (methylsulfanyl)- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: CSc1nc(N)c2c(n1)OC(=C(C2c1cccc(c1)F)C#N)N

STK780115
Synonyms: 4,7- diamino- 5- (4- fluorophenyl)- 2- (methylsulfanyl)- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: CSc1nc(N)c2c(n1)OC(=C(C2c1ccc(cc1)F)C#N)N

STK780116
Synonyms: 4,7- diamino- 5- (2- fluorophenyl)- 2- (methylsulfanyl)- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: CSc1nc(N)c2c(n1)OC(=C(C2c1ccccc1F)C#N)N

STK780119
Synonyms: ethyl5- amino- 6- cyano- 7- (4- ethylphenyl)- 2- methyl- 7H- thieno[3,2- b]pyran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)sc2c1OC(=C(C2c1ccc(cc1)CC)C#N)N

STK780122
Synonyms: 2- [2,5- dioxo- 4- (3,4,5- trimethoxyphenyl)- 3,4,5,6,7,8- hexahydroquinolin- 1(2H)- yl]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)N(C2=C1C(=O)CCC2)c1sc2c(c1C#N)CCCC2

STK780126
Synonyms: 4,7- diamino- 2- [(2- chlorobenzyl)sulfanyl]- 5- (3- fluorophenyl)- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1)F)c(N)nc(n2)SCc1ccccc1Cl

STK780127
Synonyms: 4,7- diamino- 2- [(2- chlorobenzyl)sulfanyl]- 5- (4- fluorophenyl)- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)F)c(N)nc(n2)SCc1ccccc1Cl

STK780128
Synonyms: 4,7- diamino- 2- (benzylsulfanyl)- 5- (2- fluorophenyl)- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1F)c(N)nc(n2)SCc1ccccc1

STK780131
Synonyms: 4- (4- hydroxy- 3- methoxyphenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: COc1cc(ccc1O)C1CC(=O)NC2=C1C(=O)CCC2

STK780133
Synonyms: 3- phenyl- 4- (thiophen- 3- yl)- 1,4,5,7- tetrahydro- 6H- pyrazolo[3,4- b]pyridin- 6- one
Smiles: O=C1CC(c2cscc2)c2c(N1)[nH]nc2c1ccccc1

STK780134
Synonyms: 4,7- diamino- 2- [(2- chlorobenzyl)sulfanyl]- 5- (2- fluorophenyl)- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1F)c(N)nc(n2)SCc1ccccc1Cl

STK780135
Synonyms: 4,7- diamino- 5- (3- methoxyphenyl)- 2- (methylsulfanyl)- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: COc1cccc(c1)C1C(=C(N)Oc2c1c(N)nc(n2)SC)C#N

STK780137
Synonyms: 5- (2- chlorophenyl)- 2- (methylsulfanyl)- 5,8- dihydropyrido[2,3- d]pyrimidine- 4,7(3H,6H)- dione
Smiles: CSc1nc2NC(=O)CC(c2c(=O)[nH]1)c1ccccc1Cl

STK780141
Synonyms: 4- (5- bromo- 2- fluorophenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: O=C1NC2=C(C(C1)c1cc(Br)ccc1F)C(=O)CCC2

STK685630
Synonyms: (2E)- N- (5- chloro- 1,4,6- trimethyl- 1H- pyrazolo[3,4- b]pyridin- 3- yl)- 3- phenylprop- 2- enamide
Smiles: O=C(Nc1nn(c2c1c(C)c(Cl)c(n2)C)C)/C=C/c1ccccc1

STK780147
Synonyms: (3- amino- 4,5,6- trimethylthieno[2,3- b]pyridin- 2- yl)(4- methylpiperidin- 1- yl)methanone
Smiles: CC1CCN(CC1)C(=O)c1sc2c(c1N)c(C)c(c(n2)C)C

STK780154
Synonyms: (3- amino- 4,6- dimethylthieno[2,3- b]pyridin- 2- yl)(4- methylpiperidin- 1- yl)methanone
Smiles: CC1CCN(CC1)C(=O)c1sc2c(c1N)c(C)cc(n2)C

STK685631
Synonyms: N- ethyl- 8- methoxy- N- phenylquinoline- 5- sulfonamide
Smiles: CCN(S(=O)(=O)c1ccc(c2c1cccn2)OC)c1ccccc1

STK685632
Synonyms: N- (furan- 2- ylmethyl)- 8- methoxyquinoline- 5- sulfonamide
Smiles: COc1ccc(c2c1nccc2)S(=O)(=O)NCc1ccco1

STK685633
Synonyms: 2- {[2- (diethylamino)ethyl]amino}- 4- (methoxymethyl)- 6- methylpyridine- 3- carbonitrile
Smiles: COCc1cc(C)nc(c1C#N)NCCN(CC)CC

STK685634
Synonyms: 4- (methoxymethyl)- 6- methyl- 2- [(2,2,6,6- tetramethylpiperidin- 4- yl)amino]pyridine- 3- carbonitrile
Smiles: COCc1cc(C)nc(c1C#N)NC1CC(C)(C)NC(C1)(C)C

STK780159
Synonyms: 2- (benzylamino)- 4- (methoxymethyl)- 6- methylpyridine- 3- carboxamide
Smiles: COCc1cc(C)nc(c1C(=O)N)NCc1ccccc1

STK780161
Synonyms: 2- [3- amino- 4- (methoxymethyl)- 6- methylthieno[2,3- b]pyridin- 2- yl]quinazolin- 4(3H)- one
Smiles: COCc1cc(C)nc2c1c(N)c(s2)c1nc2ccccc2c(=O)[nH]1

STK780163
Synonyms: 2- butyl- 3- (2- hydroxyethyl)- 9- (methoxymethyl)- 7- methylpyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 4(3H)- one
Smiles: CCCCc1nc2c3c(COC)cc(nc3sc2c(=O)n1CCO)C

STK780164
Synonyms: 3- butyl- 2- ethyl- 9- (methoxymethyl)- 7- methylpyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 4(3H)- one
Smiles: CCCCn1c(CC)nc2c(c1=O)sc1c2c(COC)cc(n1)C

STK780165
Synonyms: 2- ethyl- 3- (2- hydroxyethyl)- 9- (methoxymethyl)- 7- methylpyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 4(3H)- one
Smiles: COCc1cc(C)nc2c1c1nc(CC)n(c(=O)c1s2)CCO

STK780166
Synonyms: (1Z)- 1- {[3- (4- methoxyphenyl)- 1H- pyrazol- 4- yl]methylidene}- 6- methyl- 4- thioxo- 4,5- dihydrofuro[3,4- c]pyridin- 3(1H)- one
Smiles: COc1ccc(cc1)c1n[nH]cc1/C=C/1\OC(=O)c2c1cc(C)[nH]c2=S

STK780167
Synonyms: (1Z)- 6- methyl- 1- {[3- (thiophen- 2- yl)- 1H- pyrazol- 4- yl]methylidene}- 4- thioxo- 4,5- dihydrofuro[3,4- c]pyridin- 3(1H)- one
Smiles: O=C1O/C(=C\c2c[nH]nc2c2cccs2)/c2c1c(=S)[nH]c(c2)C

STK780168
Synonyms: (1Z)- 1- {[3- (4- fluorophenyl)- 1H- pyrazol- 4- yl]methylidene}- 6- methyl- 4- thioxo- 4,5- dihydrofuro[3,4- c]pyridin- 3(1H)- one
Smiles: Fc1ccc(cc1)c1n[nH]cc1/C=C/1\OC(=O)c2c1cc(C)[nH]c2=S

STK780169
Synonyms: (1Z)- 6- methyl- 1- {[3- (3- nitrophenyl)- 1H- pyrazol- 4- yl]methylidene}- 4- thioxo- 4,5- dihydrofuro[3,4- c]pyridin- 3(1H)- one
Smiles: [O-][N+](=O)c1cccc(c1)c1n[nH]cc1/C=C/1\OC(=O)c2c1cc(C)[nH]c2=S

STK780170
Synonyms: 4- (hydroxymethyl)- 6- methyl- 2- thioxo- 1,2- dihydropyridine- 3- carbohydrazide
Smiles: NNC(=O)c1c(CO)cc([nH]c1=S)C

STK780171
Synonyms: 4- (methoxymethyl)- 6- methyl- 2- propoxypyridine- 3- carboxamide
Smiles: CCCOc1nc(C)cc(c1C(=O)N)COC

STK685639
Synonyms: ethyl3- [(dichloroacetyl)amino]- 4- (methoxymethyl)- 6- methylthieno[2,3- b]pyridine- 2- carboxylate
Smiles: CCOC(=O)c1sc2c(c1NC(=O)C(Cl)Cl)c(COC)cc(n2)C

STK780181
Synonyms: N- (2- butoxyphenyl)- 2,4- dichloro- 5- (cyclopropylsulfamoyl)benzamide
Smiles: CCCCOc1ccccc1NC(=O)c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1

STK685641
Synonyms: 4- amino- N- (octahydro- 2H- quinolizin- 1- ylmethyl)- 1,2,5- oxadiazole- 3- carboxamide2- oxide
Smiles: O=C(c1c(N)no[n+]1[O-])NCC1CCCN2C1CCCC2

STK780188
Synonyms: (3- amino- 4,6- dimethyl- 1H- pyrazolo[3,4- b]pyridin- 1- yl)(4- chlorophenyl)methanone
Smiles: Clc1ccc(cc1)C(=O)n1nc(c2c1nc(C)cc2C)N

STK780191
Synonyms: ethyl[2- ({[(5- ethyl- 4- methyl- 6- oxo- 1,6- dihydropyrimidin- 2- yl)sulfanyl]acetyl}amino)- 4- methyl- 1,3- thiazol- 5- yl]acetate
Smiles: CCOC(=O)Cc1sc(nc1C)NC(=O)CSc1nc(C)c(c(=O)[nH]1)CC

STK780196
Synonyms: 2- (benzylsulfonyl)- 1- (pyridin- 2- ylmethyl)- 1H- benzimidazole
Smiles: O=S(=O)(c1nc2c(n1Cc1ccccn1)cccc2)Cc1ccccc1

STK780198
Synonyms: 1,3,7- trimethyl- 8- ({1- [2- (morpholin- 4- yl)- 2- oxoethyl]- 3- nitro- 1H- 1,2,4- triazol- 5- yl}sulfanyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=C(N1CCOCC1)Cn1nc(nc1Sc1nc2c(n1C)c(=O)n(c(=O)n2C)C)[N+](=O)[O-]

STK780199
Synonyms: 2- [4- (2,3- dimethoxyphenyl)- 2,5- dioxo- 3,4,5,6,7,8- hexahydroquinolin- 1(2H)- yl]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: COc1c(OC)cccc1C1CC(=O)N(C2=C1C(=O)CCC2)c1sc2c(c1C#N)CCCC2

STK780204
Synonyms: 2- [4- (4- methoxyphenyl)- 2,5- dioxo- 3,4,5,6,7,8- hexahydroquinolin- 1(2H)- yl]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: COc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CCC2)c1sc2c(c1C#N)CCCC2

STK780208
Synonyms: 4- [3- (3- hydroxyphenyl)- 1H- pyrazol- 4- yl]- 6- methyl- 4,6- dihydro- 2H- pyrano[3,2- c]quinoline- 2,5(3H)- dione
Smiles: O=C1CC(c2c[nH]nc2c2cccc(c2)O)c2c(O1)c1ccccc1n(c2=O)C

STK780210
Synonyms: 4,7- diamino- 2- (methylsulfanyl)- 5- phenyl- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: CSc1nc(N)c2c(n1)OC(=C(C2c1ccccc1)C#N)N

STK780212
Synonyms: 4,7- diamino- 2- (methylsulfanyl)- 5- (pyridin- 3- yl)- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: CSc1nc(N)c2c(n1)OC(=C(C2c1cccnc1)C#N)N

STK780213
Synonyms: 4,7- diamino- 2- (prop- 2- yn- 1- ylsulfanyl)- 5- (pyridin- 3- yl)- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: C#CCSc1nc(N)c2c(n1)OC(=C(C2c1cccnc1)C#N)N

STK780214
Synonyms: 4,7- diamino- 2- [(2- chlorobenzyl)sulfanyl]- 5- (pyridin- 3- yl)- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccnc1)c(N)nc(n2)SCc1ccccc1Cl

STK780215
Synonyms: 4,7- diamino- 5- (3- chlorophenyl)- 2- (methylsulfanyl)- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: CSc1nc(N)c2c(n1)OC(=C(C2c1cccc(c1)Cl)C#N)N

STK780217
Synonyms: 4,7- diamino- 5- (5- bromo- 2- fluorophenyl)- 2- (methylsulfanyl)- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: CSc1nc(N)c2c(n1)OC(=C(C2c1cc(Br)ccc1F)C#N)N

STK780221
Synonyms: 4,7- diamino- 2- [(2- chlorobenzyl)sulfanyl]- 5- [4- (trifluoromethyl)phenyl]- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)C(F)(F)F)c(N)nc(n2)SCc1ccccc1Cl

STK780229
Synonyms: ethyl3- ({[5- (2- chlorophenyl)- 2H- tetrazol- 2- yl]acetyl}amino)- 3- (4- methoxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)OC)NC(=O)Cn1nnc(n1)c1ccccc1Cl

STK780230
Synonyms: ethyl3- ({[5- (2- fluorophenyl)- 2H- tetrazol- 2- yl]acetyl}amino)- 3- (4- methoxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)OC)NC(=O)Cn1nnc(n1)c1ccccc1F

STK780231
Synonyms: 1- (2,4- dichlorobenzyl)- 4- nitro- 1H- pyrazole- 3- carboxamide
Smiles: Clc1ccc(c(c1)Cl)Cn1nc(c(c1)[N+](=O)[O-])C(=O)N

STK780234
Synonyms: 2- {[4- (morpholin- 4- yl)- 1,2,5- thiadiazol- 3- yl]oxy}- N- (thiophen- 2- ylmethyl)acetamide
Smiles: O=C(NCc1cccs1)COc1nsnc1N1CCOCC1

STK780237
Synonyms: N,N- dimethyl- 6- ({5- [4- (trifluoromethyl)phenyl]- 2H- tetrazol- 2- yl}methyl)- 1,3,5- triazine- 2,4- diamine
Smiles: Nc1nc(Cn2nnc(n2)c2ccc(cc2)C(F)(F)F)nc(n1)N(C)C

STK780241
Synonyms: N- ethyl- 2- {[4- (morpholin- 4- yl)- 1,2,5- thiadiazol- 3- yl]oxy}- N- phenylacetamide
Smiles: CCN(c1ccccc1)C(=O)COc1nsnc1N1CCOCC1

STK780243
Synonyms: N- (2,3- dichlorophenyl)- 2- {[4- (morpholin- 4- yl)- 1,2,5- thiadiazol- 3- yl]oxy}acetamide
Smiles: O=C(Nc1cccc(c1Cl)Cl)COc1nsnc1N1CCOCC1

STK780244
Synonyms: ethyl3- (2- chlorophenyl)- 3- ({[5- (4- chlorophenyl)- 2H- tetrazol- 2- yl]acetyl}amino)propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)Cn1nnc(n1)c1ccc(cc1)Cl

STK780245
Synonyms: N- (2,4- dimethylphenyl)- 2- {[4- (morpholin- 4- yl)- 1,2,5- thiadiazol- 3- yl]oxy}acetamide
Smiles: O=C(Nc1ccc(cc1C)C)COc1nsnc1N1CCOCC1

STK685656
Synonyms: 2- {[(4E)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylideneamino]oxy}- N- (4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CO/N=C/1\CCCc2c1non2

STK780251
Synonyms: (4E)- N- [(6- bromo- 1,3- benzodioxol- 5- yl)methoxy]- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- imine
Smiles: Brc1cc2OCOc2cc1CO/N=C/1\CCCc2c1non2

STK685657
Synonyms: 2- (5- {4- [(2- chlorobenzyl)oxy]phenyl}- 2H- tetrazol- 2- yl)- N- (3- methylpent- 1- yn- 3- yl)acetamide
Smiles: CCC(NC(=O)Cn1nnc(n1)c1ccc(cc1)OCc1ccccc1Cl)(C#C)C

STK780252
Synonyms: 2- [5- (4- chlorophenyl)- 2H- tetrazol- 2- yl]- N- [2- (3,4- dimethoxyphenyl)ethyl]acetamide
Smiles: COc1cc(CCNC(=O)Cn2nnc(n2)c2ccc(cc2)Cl)ccc1OC

STK780253
Synonyms: N- (4- methoxyphenyl)- 2- {[4- (morpholin- 4- yl)- 1,2,5- thiadiazol- 3- yl]oxy}acetamide
Smiles: COc1ccc(cc1)NC(=O)COc1nsnc1N1CCOCC1

STK780256
Synonyms: methyl1- {2- [(2,4- dimethylphenyl)amino]- 2- oxoethyl}- 1H- pyrazole- 3- carboxylate
Smiles: COC(=O)c1ccn(n1)CC(=O)Nc1ccc(cc1C)C

STK780260
Synonyms: 2- (5- {4- [(2- fluorobenzyl)oxy]phenyl}- 2H- tetrazol- 2- yl)- N- (3- methylpent- 1- yn- 3- yl)acetamide
Smiles: CCC(NC(=O)Cn1nnc(n1)c1ccc(cc1)OCc1ccccc1F)(C#C)C

STK780261
Synonyms: 1- {[4- amino- 6- (dimethylamino)- 1,3,5- triazin- 2- yl]methyl}- 3,5- dimethyl- 1,3,5- triazinane- 2,4,6- trione
Smiles: Nc1nc(nc(n1)N(C)C)Cn1c(=O)n(C)c(=O)n(c1=O)C

STK780264
Synonyms: 1- (morpholin- 4- yl)- 2- [5- (thiophen- 2- yl)- 2H- tetrazol- 2- yl]ethanone
Smiles: O=C(N1CCOCC1)Cn1nnc(n1)c1cccs1

STK780268
Synonyms: N- [4- (morpholin- 4- ylcarbonyl)phenyl]- 2- [(5- propyl- 5H- [1,2,4]triazino[5,6- b]indol- 3- yl)sulfanyl]acetamide
Smiles: CCCn1c2ccccc2c2c1nc(SCC(=O)Nc1ccc(cc1)C(=O)N1CCOCC1)nn2

STK780270
Synonyms: 4- methylcyclohexyl4- {[1- (2- chlorophenyl)- 3- ethoxy- 3- oxopropyl]amino}- 4- oxobutanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)CCC(=O)OC1CCC(CC1)C

STK780272
Synonyms: 4- methylcyclohexyl4- {[2- (5- fluoro- 2- methyl- 1H- indol- 3- yl)ethyl]amino}- 4- oxobutanoate
Smiles: CC1CCC(CC1)OC(=O)CCC(=O)NCCc1c(C)[nH]c2c1cc(F)cc2

STK685661
Synonyms: N- (1H- indazol- 6- yl)- 3,4- dimethoxybenzamide
Smiles: COc1cc(ccc1OC)C(=O)Nc1ccc2c(c1)[nH]nc2

STK780280
Synonyms: N- [3- (trifluoromethyl)phenyl][1,2,4]triazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: O=C(c1nn2c(n1)nccc2)Nc1cccc(c1)C(F)(F)F

STK780282
Synonyms: 2- {[(1,5- dimethyl- 1H- pyrazol- 4- yl)sulfonyl]amino}benzamide
Smiles: NC(=O)c1ccccc1NS(=O)(=O)c1cnn(c1C)C

STK780285
Synonyms: 2- amino- 1- (3- chloro- 2- methylphenyl)- 4- [4- (morpholin- 4- ylmethyl)thiophen- 2- yl]- 5- oxo- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1scc(c1)CN1CCOCC1)C(=O)CCC2)c1cccc(c1C)Cl

STK780290
Synonyms: ethyl2- methyl- 4- (4- {[(1- methyl- 1H- tetrazol- 5- yl)sulfanyl]methyl}thiophen- 2- yl)- 5- oxo- 1,4,5,6,7,8- hexahydroquinoline- 3- carboxylate
Smiles: CCOC(=O)C1=C(C)NC2=C(C1c1scc(c1)CSc1nnnn1C)C(=O)CCC2

STK685664
Synonyms: 1- (2- methyl- 2,3- dihydro- 1H- indol- 1- yl)- 3- (4- methylpiperidin- 1- yl)propan- 1- one
Smiles: CC1CCN(CC1)CCC(=O)N1C(C)Cc2c1cccc2

STK780292
Synonyms: (1S,2S,5R)- 2- {4- methyl- 3- [(5- phenyl- 2H- tetrazol- 2- yl)methyl]- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 1- yl}- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: O=C1C[C@@H]([C@@H]2O[C@H]1OC2)n1nc(n(c1=S)C)Cn1nnc(n1)c1ccccc1

STK780294
Synonyms: 3,6- bis[(pyridin- 2- ylmethyl)sulfanyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: c1ccc(nc1)CSc1nn2c(s1)nnc2SCc1ccccn1

STK685666
Synonyms: 2,4- dichloro- 5- (cyclopropylsulfamoyl)- N- (pyridin- 3- yl)benzamide
Smiles: O=C(c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1)Nc1cccnc1

STK685668
Synonyms: methylS- benzyl- N- {[(4- methyl- 6- oxo- 1,6- dihydropyrimidin- 2- yl)sulfanyl]acetyl}cysteinate
Smiles: COC(=O)C(NC(=O)CSc1nc(C)cc(=O)[nH]1)CSCc1ccccc1

STK780300
Synonyms: methyl2,7,7- trimethyl- 4- [4- (morpholin- 4- ylmethyl)thiophen- 2- yl]- 5- oxo- 1,4,5,6,7,8- hexahydroquinoline- 3- carboxylate
Smiles: COC(=O)C1=C(C)NC2=C(C1c1scc(c1)CN1CCOCC1)C(=O)CC(C2)(C)C

STK780310
Synonyms: 7'- nitro- 1- propyl- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- trione
Smiles: CCCN1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCC1)[N+](=O)[O-]

STK780311
Synonyms: 3- butyl- 7,7,8a- trimethyl- 5- thioxotetrahydro- 5H- [1,3]oxazolo[3,2- c]pyrimidin- 2(3H)- one
Smiles: CCCCC1C(=O)OC2(N1C(=S)NC(C2)(C)C)C

STK685673
Synonyms: 3- (1H- imidazol- 4- ylmethyl)- 7,7,8a- trimethyl- 5- thioxotetrahydro- 5H- [1,3]oxazolo[3,2- c]pyrimidin- 2(3H)- one
Smiles: O=C1OC2(N(C1Cc1nc[nH]c1)C(=S)NC(C2)(C)C)C

STK780321
Synonyms: N- (4- fluorobenzyl)- 1,5- dimethyl- 1H- pyrazole- 4- sulfonamide
Smiles: Fc1ccc(cc1)CNS(=O)(=O)c1cnn(c1C)C

STK780323
Synonyms: N- (3,4- dimethoxybenzyl)- 1,5- dimethyl- 1H- pyrazole- 4- sulfonamide
Smiles: COc1cc(ccc1OC)CNS(=O)(=O)c1cnn(c1C)C

STK780326
Synonyms: N- (3- fluorophenyl)- 1,5- dimethyl- 1H- pyrazole- 4- sulfonamide
Smiles: Fc1cccc(c1)NS(=O)(=O)c1cnn(c1C)C

STK780327
Synonyms: 1,5- dimethyl- N- [4- (1,2- oxazol- 5- yl)phenyl]- 1H- pyrazole- 4- sulfonamide
Smiles: Cn1ncc(c1C)S(=O)(=O)Nc1ccc(cc1)c1ccno1

STK685675
Synonyms: 1- (4- methoxyphenyl)- 3- {[4- (trifluoromethoxy)phenyl]amino}propan- 1- one
Smiles: COc1ccc(cc1)C(=O)CCNc1ccc(cc1)OC(F)(F)F

STK780331
Synonyms: 2- chloro- 4- (4,5- diphenyl- 1H- imidazol- 2- yl)- 6- methoxyphenol
Smiles: COc1cc(cc(c1O)Cl)c1nc(c([nH]1)c1ccccc1)c1ccccc1

STK780341
Synonyms: 1'- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 4,7- dihydrospiro[1,3- dioxepine- 2,3'- indol]- 2'(1'H)- one
Smiles: Fc1ccc(cc1)N1CCN(CC1)CN1c2ccccc2C2(C1=O)OCC=CCO2

STK780342
Synonyms: 1'- {[4- (2- fluorophenyl)piperazin- 1- yl]methyl}- 4,7- dihydrospiro[1,3- dioxepine- 2,3'- indol]- 2'(1'H)- one
Smiles: Fc1ccccc1N1CCN(CC1)CN1c2ccccc2C2(C1=O)OCC=CCO2

STK780343
Synonyms: 4- [1- (1H- indol- 3- yl)- 2- nitroethyl]benzonitrile
Smiles: N#Cc1ccc(cc1)C(c1c[nH]c2c1cccc2)C[N+](=O)[O-]

STK685687
Synonyms: (2'- oxo- 1',2'- dihydrospiro[1,3- dioxolane- 2,3'- indol]- 4- yl)methyl2- hydroxybenzoate
Smiles: O=C(c1ccccc1O)OCC1COC2(O1)C(=O)Nc1c2cccc1

STK685688
Synonyms: 4- methyl- 3- (1H- tetrazol- 5- yl)- 1- oxaspiro[4.5]dec- 3- en- 2- one
Smiles: O=C1OC2(C(=C1c1nnn[nH]1)C)CCCCC2

STK685689
Synonyms: 3- acetyl- 2- [(2- fluorophenyl)amino]- 6- methyl- 4H- pyran- 4- one
Smiles: Cc1cc(=O)c(c(o1)Nc1ccccc1F)C(=O)C

STK685690
Synonyms: ethyl6- (4- methoxyphenyl)- 3- (trifluoromethyl)- 6,7- dihydro- 5H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazine- 7- carboxylate
Smiles: CCOC(=O)C1Sc2nnc(n2NC1c1ccc(cc1)OC)C(F)(F)F

STK685691
Synonyms: ethyl6- phenyl- 3- (trifluoromethyl)- 6,7- dihydro- 5H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazine- 7- carboxylate
Smiles: CCOC(=O)C1Sc2nnc(n2NC1c1ccccc1)C(F)(F)F

STK685692
Synonyms: (4- chlorophenyl)[6- (4- methoxyphenyl)- 3- methyl- 6,7- dihydro- 5H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazin- 7- yl]methanone
Smiles: COc1ccc(cc1)C1Nn2c(SC1C(=O)c1ccc(cc1)Cl)nnc2C

STK685694
Synonyms: 7- amino- 3- methyl- 4- oxo- 1,4- dihydropyrazolo[5,1- c][1,2,4]triazine- 8- carbonitrile
Smiles: N#Cc1c(N)nn2c1[nH]nc(c2=O)C

STK685695
Synonyms: 6- (4- chlorobenzyl)- 3- (methylsulfanyl)- 1,2,4- triazin- 5(4H)- one
Smiles: CSc1nnc(c(=O)[nH]1)Cc1ccc(cc1)Cl

STK685696
Synonyms: ethyl6- (4- hydroxyphenyl)- 3- methyl- 6,7- dihydro- 5H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazine- 7- carboxylate
Smiles: CCOC(=O)C1Sc2nnc(n2NC1c1ccc(cc1)O)C

STK685697
Synonyms: N- hydroxy- 2- octylcyclopropanecarboxamide
Smiles: CCCCCCCCC1CC1C(=O)NO

STK780357
Synonyms: N- {4- [1- phenyl- 3- (trifluoromethyl)- 1H- pyrazol- 5- yl]phenyl}benzenesulfonamide
Smiles: FC(c1cc(n(n1)c1ccccc1)c1ccc(cc1)NS(=O)(=O)c1ccccc1)(F)F

STK780361
Synonyms: 3,4- dimethoxy- N- [1- (2- methoxyphenyl)- 3- methyl- 1H- pyrazol- 5- yl]benzamide
Smiles: COc1cc(ccc1OC)C(=O)Nc1cc(nn1c1ccccc1OC)C

STK780362
Synonyms: N- {4- [3,5- bis(trifluoromethyl)- 1H- pyrazol- 1- yl]phenyl}- 2,3- dihydro- 1,4- benzodioxine- 6- sulfonamide
Smiles: O=S(=O)(c1ccc2c(c1)OCCO2)Nc1ccc(cc1)n1nc(cc1C(F)(F)F)C(F)(F)F

STK780364
Synonyms: 3a,5,5,9b- tetramethyl- 3a,4,5,9b- tetrahydronaphtho[1,2- d][1,3]dioxol- 2- one
Smiles: O=C1OC2(C(O1)(C)CC(c1c2cccc1)(C)C)C

STK780366
Synonyms: 2- methoxy- 6- (3- methoxyphenyl)- 3- [5- (2- methoxyphenyl)- 1,2,4- oxadiazol- 3- yl]pyridine
Smiles: COc1cccc(c1)c1ccc(c(n1)OC)c1noc(n1)c1ccccc1OC

STK780367
Synonyms: (2Z)- 2- {(1R,2R,5S)- 2- [4- (4- chlorophenyl)- 5- thioxo- 4,5- dihydro- 1H- tetrazol- 1- yl]- 6,8- dioxabicyclo[3.2.1]oct- 4- ylidene}hydrazinecarbothioamide(non- preferredname)
Smiles: NC(=S)N/N=C\1/C[C@H]([C@H]2O[C@@H]1OC2)n1nnn(c1=S)c1ccc(cc1)Cl

STK780369
Synonyms: ethyl3- ({[2,4- dichloro- 5- (cyclopropylsulfamoyl)phenyl]carbonyl}amino)- 3- (4- methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1cc(c(cc1Cl)Cl)S(=O)(=O)NC1CC1

STK780371
Synonyms: 5- (4- chloro- 1- ethyl- 1H- pyrazol- 3- yl)- 4- (2,5- dimethoxyphenyl)- 4H- 1,2,4- triazole- 3- thiol
Smiles: COc1ccc(cc1n1c(S)nnc1c1nn(cc1Cl)CC)OC

STK685702
Synonyms: N'- [(2E)- 9,10- dimethoxy- 3- (2- methylpropyl)- 1,3,4,6,7,11b- hexahydro- 2H- pyrido[2,1- a]isoquinolin- 2- ylidene]pyridine- 4- carbohydrazide
Smiles: COc1cc2c(cc1OC)CCN1C2C/C(=N\NC(=O)c2ccncc2)/C(C1)CC(C)C

STK780372
Synonyms: methyl1- (2- chlorobenzyl)- 1H- pyrazole- 3- carboxylate
Smiles: COC(=O)c1ccn(n1)Cc1ccccc1Cl

STK780377
Synonyms: 2- fluoro- 5- {4- [(4- methylphenyl)sulfonyl]piperazin- 1- yl}- 4- nitro- N- (tetrahydrofuran- 2- ylmethyl)aniline
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cc(NCC2CCCO2)c(cc1[N+](=O)[O-])F

STK780378
Synonyms: 1- (1- benzofuran- 2- yl)- 3- [(3- bromophenyl)amino]propan- 1- one
Smiles: Brc1cccc(c1)NCCC(=O)c1cc2c(o1)cccc2

STK685703
Synonyms: 6- chloro- N- (2,3- dimethylphenyl)- 2H- 1,4- benzoxazin- 3- amine
Smiles: Clc1ccc2c(c1)N=C(CO2)Nc1cccc(c1C)C

STK685704
Synonyms: ethyl3- [(6- methylpyridin- 2- yl)carbamoyl]pyrazine- 2- carboxylate
Smiles: CCOC(=O)c1nccnc1C(=O)Nc1cccc(n1)C

STK780380
Synonyms: 2- [2- (3,4- diethoxyphenyl)ethyl]- 1H- pyrrolo[3,4- c]pyridine- 1,3(2H)- dione
Smiles: CCOc1cc(ccc1OCC)CCN1C(=O)c2c(C1=O)cncc2

STK780381
Synonyms: 2- (2- methoxyphenyl)- 1H- pyrrolo[3,4- c]pyridine- 1,3(2H)- dione
Smiles: COc1ccccc1N1C(=O)c2c(C1=O)cncc2

STK780382
Synonyms: 2- (3,4- dichlorophenyl)- 1H- pyrrolo[3,4- c]pyridine- 1,3(2H)- dione
Smiles: Clc1cc(ccc1Cl)N1C(=O)c2c(C1=O)cncc2

STK780384
Synonyms: 2- bromobenzyl1,2- dimethyl- 4- nitro- 1H- imidazole- 5- carboxylate
Smiles: O=C(c1c(nc(n1C)C)[N+](=O)[O-])OCc1ccccc1Br

STK780386
Synonyms: 6- methyl- 2,4- dioxo- N- (thiophen- 2- ylmethyl)- 1,2,3,4- tetrahydropyrimidine- 5- sulfonamide
Smiles: Cc1[nH]c(=O)[nH]c(=O)c1S(=O)(=O)NCc1cccs1

STK780387
Synonyms: N- (2- phenylethyl)- 2- {5- [4- (trifluoromethyl)phenyl]- 2H- tetrazol- 2- yl}acetamide
Smiles: O=C(Cn1nnc(n1)c1ccc(cc1)C(F)(F)F)NCCc1ccccc1

STK780388
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 2- {5- [3- (trifluoromethyl)phenyl]- 2H- tetrazol- 2- yl}acetamide
Smiles: COc1cc(CCNC(=O)Cn2nnc(n2)c2cccc(c2)C(F)(F)F)ccc1OC

STK780392
Synonyms: N- methyl- 2- {[4- (morpholin- 4- yl)- 1,2,5- thiadiazol- 3- yl]oxy}- N- phenylacetamide
Smiles: CN(c1ccccc1)C(=O)COc1nsnc1N1CCOCC1

STK780393
Synonyms: 4- {4- [(3- methoxybenzyl)oxy]- 1,2,5- thiadiazol- 3- yl}morpholine
Smiles: COc1cccc(c1)COc1nsnc1N1CCOCC1

STK780394
Synonyms: 2,6- dichlorobenzyl2- amino- 4- methyl- 1,3- thiazole- 5- carboxylate
Smiles: Nc1nc(c(s1)C(=O)OCc1c(Cl)cccc1Cl)C

STK685705
Synonyms: N- cyclohexyl- 2- {[4- (morpholin- 4- yl)- 1,2,5- thiadiazol- 3- yl]oxy}acetamide
Smiles: O=C(NC1CCCCC1)COc1nsnc1N1CCOCC1

STK780398
Synonyms: N- (3- methylpent- 1- yn- 3- yl)- 2- [5- (thiophen- 2- yl)- 2H- tetrazol- 2- yl]acetamide
Smiles: CCC(NC(=O)Cn1nnc(n1)c1cccs1)(C#C)C

STK780401
Synonyms: 6- [({4- ethyl- 5- [(5- phenyl- 2H- tetrazol- 2- yl)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)methyl]- N,N- dimethyl- 1,3,5- triazine- 2,4- diamine
Smiles: CCn1c(nnc1SCc1nc(N)nc(n1)N(C)C)Cn1nnc(n1)c1ccccc1

STK780402
Synonyms: 2- ({4- ethyl- 5- [(5- phenyl- 2H- tetrazol- 2- yl)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [4- (trifluoromethoxy)phenyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)OC(F)(F)F)nnc1Cn1nnc(n1)c1ccccc1

STK780404
Synonyms: (6- bromo- 1,3- benzodioxol- 5- yl)methyl5- amino- 2- phenyl- 2H- 1,2,3- triazole- 4- carboxylate
Smiles: O=C(c1nn(nc1N)c1ccccc1)OCc1cc2OCOc2cc1Br

STK780405
Synonyms: N- [(6- bromo- 1,3- benzodioxol- 5- yl)methoxy]- 2,4- dimethyl- 3H- 1,5- benzodiazepin- 3- imine
Smiles: Brc1cc2OCOc2cc1CO/N=c/1\c(C)nc2c(nc1C)cccc2

STK780406
Synonyms: 4- {4- [(6- bromo- 1,3- benzodioxol- 5- yl)methoxy]- 1,2,5- thiadiazol- 3- yl}morpholine
Smiles: Brc1cc2OCOc2cc1COc1nsnc1N1CCOCC1

STK780407
Synonyms: methyl1- [(6- bromo- 1,3- benzodioxol- 5- yl)methyl]- 1H- pyrazole- 3- carboxylate
Smiles: COC(=O)c1ccn(n1)Cc1cc2OCOc2cc1Br

STK685707
Synonyms: 10- chloroindolo[3',2':3,4]pyridazino[6,1- b]quinazolin- 7(14H)- one
Smiles: Clc1ccc2c(c1)nc1n(c2=O)nc2c(c1)[nH]c1c2cccc1

STK780410
Synonyms: N- [4- (cyclohexylcarbamoyl)phenyl]- 2- oxo- 1- oxaspiro[4.5]decane- 4- carboxamide
Smiles: O=C1CC(C2(O1)CCCCC2)C(=O)Nc1ccc(cc1)C(=O)NC1CCCCC1

STK780411
Synonyms: N- [4- (morpholin- 4- ylcarbonyl)phenyl]- 2- oxo- 1- oxaspiro[4.5]decane- 4- carboxamide
Smiles: O=C1CC(C2(O1)CCCCC2)C(=O)Nc1ccc(cc1)C(=O)N1CCOCC1

STK780414
Synonyms: N- (2,4- dimethoxyphenyl)- 3,4- dihydro- 1H- isochromene- 1- carboxamide
Smiles: COc1cc(OC)ccc1NC(=O)C1OCCc2c1cccc2

STK780415
Synonyms: N- (pyridin- 2- yl)- 3,4- dihydro- 1H- isochromene- 1- carboxamide
Smiles: O=C(C1OCCc2c1cccc2)Nc1ccccn1

STK780416
Synonyms: 3- (10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)propanoicacid
Smiles: OC(=O)CCc1nc2n(n1)cnc1c2c2CC(C)(C)OCc2s1

STK685708
Synonyms: 4,5,5- trimethyl- 3- (1H- tetrazol- 5- yl)furan- 2(5H)- one
Smiles: O=C1OC(C(=C1c1nnn[nH]1)C)(C)C

STK780421
Synonyms: 1- (hexan- 2- yl)- 4,6- dimethyl- 1H- pyrazolo[3,4- b]pyridin- 3- ol
Smiles: CCCCC(n1nc(c2c1nc(C)cc2C)O)C

STK780422
Synonyms: 1- (2,2- dimethyltetrahydro- 2H- pyran- 4- yl)- 4,6- dimethyl- 1H- pyrazolo[3,4- b]pyridin- 3- ol
Smiles: Cc1cc(C)c2c(n1)n(nc2O)C1CCOC(C1)(C)C

STK780424
Synonyms: 3- hydroxy- 4- (4- methylphenyl)- 1- (propan- 2- yl)- 4,8- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7(6H)- one
Smiles: O=C1CSC(c2c(N1)n(nc2O)C(C)C)c1ccc(cc1)C

STK780425
Synonyms: 1- (butan- 2- yl)- 4- (4- fluorophenyl)- 3- hydroxy- 4,8- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7(6H)- one
Smiles: CCC(n1nc(c2c1NC(=O)CSC2c1ccc(cc1)F)O)C

STK780426
Synonyms: 3- hydroxy- 1- (pentan- 2- yl)- 4- phenyl- 4,8- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7(6H)- one
Smiles: CCCC(n1nc(c2c1NC(=O)CSC2c1ccccc1)O)C

STK780427
Synonyms: 4- (4- chlorophenyl)- 3- hydroxy- 1- (pentan- 2- yl)- 4,8- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7(6H)- one
Smiles: CCCC(n1nc(c2c1NC(=O)CSC2c1ccc(cc1)Cl)O)C

STK780428
Synonyms: 4- (4- fluorophenyl)- 3- hydroxy- 1- (pentan- 2- yl)- 4,8- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7(6H)- one
Smiles: CCCC(n1nc(c2c1NC(=O)CSC2c1ccc(cc1)F)O)C

STK780429
Synonyms: 4- [4- (dimethylamino)phenyl]- 3- hydroxy- 1- (pentan- 2- yl)- 4,8- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7(6H)- one
Smiles: CCCC(n1nc(c2c1NC(=O)CSC2c1ccc(cc1)N(C)C)O)C

STK780430
Synonyms: 4- (2,4- dichlorophenyl)- 3- hydroxy- 1- (pentan- 2- yl)- 4,8- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7(6H)- one
Smiles: CCCC(n1nc(c2c1NC(=O)CSC2c1ccc(cc1Cl)Cl)O)C

STK780431
Synonyms: 4- (4- fluorophenyl)- 3- hydroxy- 1- (pentan- 3- yl)- 4,8- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7(6H)- one
Smiles: CCC(n1nc(c2c1NC(=O)CSC2c1ccc(cc1)F)O)CC

STK780432
Synonyms: 4- [4- (dimethylamino)phenyl]- 3- hydroxy- 1- (pentan- 3- yl)- 4,8- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7(6H)- one
Smiles: CCC(n1nc(c2c1NC(=O)CSC2c1ccc(cc1)N(C)C)O)CC

STK780444
Synonyms: 3- (4- chlorophenyl)- 6- (3,4- dichlorophenyl)- 7H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazine
Smiles: Clc1ccc(cc1)c1nnc2n1N=C(CS2)c1ccc(c(c1)Cl)Cl

STK780447
Synonyms: N- (3- fluorophenyl)[1,2,4]triazolo[4,3- a]quinoxalin- 4- amine
Smiles: Fc1cccc(c1)Nc1nc2ccccc2n2c1nnc2

STK780449
Synonyms: N- (2,5- dimethoxyphenyl)[1,2,4]triazolo[4,3- a]quinoxalin- 4- amine
Smiles: COc1ccc(cc1Nc1nc2ccccc2n2c1nnc2)OC

STK780450
Synonyms: N- (2- phenylethyl)[1,2,4]triazolo[4,3- a]quinoxalin- 4- amine
Smiles: c1ccc(cc1)CCNc1nc2ccccc2n2c1nnc2

STK685715
Synonyms: 3'- benzyl- 5'- (3- chlorophenyl)- 1- (prop- 2- yn- 1- yl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: C#CCN1c2ccccc2C2(C1=O)NC(C1C2C(=O)N(C1=O)c1cccc(c1)Cl)Cc1ccccc1

STK685717
Synonyms: 2,2'- (2- phenyl- 1H- imidazole- 4,5- diyl)dipyridine
Smiles: c1ccc(cc1)c1nc(c([nH]1)c1ccccn1)c1ccccn1

STK685719
Synonyms: 2- ({2- oxo- 2- [(phenylcarbonyl)amino]ethyl}sulfanyl)pyridine- 3- carboxylicacid
Smiles: O=C(NC(=O)c1ccccc1)CSc1ncccc1C(=O)O

STK780462
Synonyms: 6- methoxy- 1- (5- nitrofuran- 2- yl)- 2,3,4,9- tetrahydro- 1H- beta- carboline
Smiles: COc1ccc2c(c1)c1CCNC(c1[nH]2)c1ccc(o1)[N+](=O)[O-]

STK780463
Synonyms: 2- (4- amino- 1,2,5- oxadiazol- 3- yl)- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C1c2ccccc2C(=O)N1c1nonc1N

STK685725
Synonyms: 4,8,12,16- tetramethyl- 1- [2- (pyridin- 3- yl)piperidin- 1- yl]heptadec- 2- yn- 4- ol
Smiles: CC(CCCC(CCCC(C)C)C)CCCC(C#CCN1CCCCC1c1cccnc1)(O)C

STK685726
Synonyms: 4- (3,4- dichlorobenzyl)- 6- methyl- 3- sulfanyl- 1,2,4- triazin- 5(4H)- one
Smiles: Clc1ccc(cc1Cl)Cn1c(S)nnc(c1=O)C

STK685727
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- (6- methyl- 5- oxo- 3- sulfanyl- 1,2,4- triazin- 4(5H)- yl)acetamide
Smiles: O=C(Cn1c(S)nnc(c1=O)C)Nc1ccc2c(c1)OCO2

STK685728
Synonyms: 4- (4- fluorobenzyl)- 6- methyl- 3- sulfanyl- 1,2,4- triazin- 5(4H)- one
Smiles: Fc1ccc(cc1)Cn1c(S)nnc(c1=O)C

STK780465
Synonyms: 2- {[(4,6- dihydroxypyrimidin- 2- yl)sulfanyl]methyl}quinazolin- 4(3H)- one
Smiles: Oc1cc(O)nc(n1)SCc1nc2ccccc2c(=O)[nH]1

STK685730
Synonyms: 1'- methyl- 3- [(4- methylphenyl)sulfonyl]- 8- nitro- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C1=O)C

STK780474
Synonyms: 1- (1- benzofuran- 2- yl)- 3- {[4- (butylsulfanyl)phenyl]amino}propan- 1- one
Smiles: CCCCSc1ccc(cc1)NCCC(=O)c1cc2c(o1)cccc2

STK780475
Synonyms: 1- (1- benzofuran- 2- yl)- 3- [(3- chloro- 4- methylphenyl)amino]propan- 1- one
Smiles: O=C(c1cc2c(o1)cccc2)CCNc1ccc(c(c1)Cl)C

STK780477
Synonyms: 1- (1- benzofuran- 2- yl)- 3- {[4- (pyridin- 4- ylmethyl)phenyl]amino}propan- 1- one
Smiles: O=C(c1cc2c(o1)cccc2)CCNc1ccc(cc1)Cc1ccncc1

STK780480
Synonyms: 1- (1- benzofuran- 2- yl)- 3- {[3- (trifluoromethyl)phenyl]amino}propan- 1- one
Smiles: O=C(c1cc2c(o1)cccc2)CCNc1cccc(c1)C(F)(F)F

STK780482
Synonyms: 1- (1- benzofuran- 2- yl)- 3- (naphthalen- 2- ylamino)propan- 1- one
Smiles: O=C(c1cc2c(o1)cccc2)CCNc1ccc2c(c1)cccc2

STK685736
Synonyms: 1- methyloctahydro- 1H- cyclopenta[b]pyridin- 4- ol
Smiles: OC1CCN(C2C1CCC2)C

STK780486
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 1- (2,2- dimethyltetrahydro- 2H- pyran- 4- yl)- 3- methyl- 4,8- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7(6H)- one
Smiles: O=C1CSC(c2c(N1)n(nc2C)C1CCOC(C1)(C)C)c1ccc2c(c1)OCO2

STK780489
Synonyms: N- ethyl- 6- [(6- propoxypyridazin- 3- yl)oxy]- 1,3,5- triazine- 2,4- diamine
Smiles: CCCOc1ccc(nn1)Oc1nc(N)nc(n1)NCC

STK780491
Synonyms: N- ethyl- 6- {[6- (2- phenoxyethoxy)pyridazin- 3- yl]oxy}- 1,3,5- triazine- 2,4- diamine
Smiles: CCNc1nc(Oc2ccc(nn2)OCCOc2ccccc2)nc(n1)N

STK780495
Synonyms: 2,2- dimethyl- 5- (morpholin- 4- yl)- N- (2- phenylethyl)- 1,4- dihydro- 2H- thiopyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d][1,2,3]triazin- 8- amine
Smiles: CC1(C)SCc2c(C1)c1c(nc2N2CCOCC2)sc2c1nnnc2NCCc1ccccc1

STK685741
Synonyms: N- (6- tert- butyl- 3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)- 2- [5- (2- fluorophenyl)- 2H- tetrazol- 2- yl]acetamide
Smiles: N#Cc1c(NC(=O)Cn2nnc(n2)c2ccccc2F)sc2c1CCC(C2)C(C)(C)C

STK780501
Synonyms: 2- (4- hydroxy- 2- phenyl- 1,3- thiazol- 5- yl)- 2- phenyl- 1,3- thiazolidin- 4- one
Smiles: O=C1CSC(N1)(c1ccccc1)c1sc(nc1O)c1ccccc1

STK780502
Synonyms: methyl2- [({[(4E)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylideneamino]oxy}acetyl)amino]benzoate
Smiles: COC(=O)c1ccccc1NC(=O)CO/N=C/1\CCCc2c1non2

STK780503
Synonyms: methyl6- acetyl- 3- amino- 4- (trifluoromethyl)- 5,6,7,8- tetrahydrothieno[2,3- b][1,6]naphthyridine- 2- carboxylate
Smiles: COC(=O)c1sc2c(c1N)c(c1c(n2)CCN(C1)C(=O)C)C(F)(F)F

STK780504
Synonyms: 1- {3- amino- 2- [(4- fluorophenyl)carbonyl]- 4- (trifluoromethyl)- 7,8- dihydrothieno[2,3- b][1,6]naphthyridin- 6(5H)- yl}ethanone
Smiles: Fc1ccc(cc1)C(=O)c1sc2c(c1N)c(c1c(n2)CCN(C1)C(=O)C)C(F)(F)F

STK780510
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 2- {5- [4- (trifluoromethyl)phenyl]- 2H- tetrazol- 2- yl}acetamide
Smiles: COc1ccc(cc1OC)CCNC(=O)Cn1nnc(n1)c1ccc(cc1)C(F)(F)F

STK685743
Synonyms: N- (5- methyl- 1,2- oxazol- 3- yl)- 2- (pyrrolidin- 1- yl)acetamide
Smiles: O=C(Nc1noc(c1)C)CN1CCCC1

STK780516
Synonyms: 4- ethyl- 4- methyl- 4,5- dihydro- 1H- benzo[g]indazol- 3- ol
Smiles: CCC1(C)Cc2ccccc2c2c1c(O)n[nH]2

STK780517
Synonyms: 2- (4- fluorophenyl)- 5- methyl- 7- phenyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: Fc1ccc(cc1)C1N2CC3(CN1CC(C2)(C3=O)c1ccccc1)C

STK685745
Synonyms: 2- (1H- indol- 3- yl)- 5- methyl- 7- phenyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: O=C1C2(C)CN3CC1(CN(C2)C3c1c[nH]c2c1cccc2)c1ccccc1

STK685750
Synonyms: 2- (4- iodo- 1H- pyrazol- 1- yl)- N- (5- methyl- 1,2- oxazol- 3- yl)acetamide
Smiles: O=C(Nc1noc(c1)C)Cn1ncc(c1)I

STK685752
Synonyms: N- (1,3- benzothiazol- 2- yl)- 2- (4- iodo- 3,5- dimethyl- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)I)C)Nc1nc2c(s1)cccc2

STK685753
Synonyms: N- cycloheptyl- 2- (4- iodo- 3,5- dimethyl- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)I)C)NC1CCCCCC1

STK685755
Synonyms: 4- (3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)- 1- (4- iodo- 1H- pyrazol- 1- yl)butan- 1- one
Smiles: Ic1cnn(c1)C(=O)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK685756
Synonyms: 4- (3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)- 1- (4- iodo- 3,5- dimethyl- 1H- pyrazol- 1- yl)butan- 1- one
Smiles: O=C(n1nc(c(c1C)I)C)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK780533
Synonyms: N- [1- (3- methylbenzyl)- 1H- pyrazol- 3- yl]- 1,3- benzodioxole- 5- carboxamide
Smiles: Cc1cccc(c1)Cn1ccc(n1)NC(=O)c1ccc2c(c1)OCO2

STK780535
Synonyms: N- [3- methyl- 1- (3- methylbenzyl)- 1H- pyrazol- 5- yl]pyridine- 3- carboxamide
Smiles: Cc1cccc(c1)Cn1nc(cc1NC(=O)c1cccnc1)C

STK780540
Synonyms: N- (tetrahydrofuran- 2- ylmethyl)- 3- [4- (trifluoromethyl)phenyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)C(F)(F)F)NCC1CCCO1

STK685762
Synonyms: 6- (chloromethyl)- N- (3- chlorophenyl)- 1,3,5- triazine- 2,4- diamine
Smiles: ClCc1nc(nc(n1)N)Nc1cccc(c1)Cl

STK780543
Synonyms: 2- {3- methyl- 1- [2- (morpholin- 4- yl)ethyl]- 1H- 1,2,4- triazol- 5- yl}phenol
Smiles: Cc1nn(c(n1)c1ccccc1O)CCN1CCOCC1

STK780544
Synonyms: 2- methyl- 5- (3- methyl[1,2,4]triazolo[3,4- a]phthalazin- 6- yl)- N- propylbenzenesulfonamide
Smiles: CCCNS(=O)(=O)c1cc(ccc1C)c1nn2c(C)nnc2c2c1cccc2

STK780546
Synonyms: 2,2- dimethyl- 4- {[(thiophen- 2- ylmethyl)amino]methyl}tetrahydro- 2H- pyran- 4- ol
Smiles: OC1(CNCc2cccs2)CCOC(C1)(C)C

STK780547
Synonyms: 4- {[(2- fluorobenzyl)amino]methyl}- 2,2- dimethyltetrahydro- 2H- pyran- 4- ol
Smiles: Fc1ccccc1CNCC1(O)CCOC(C1)(C)C

STK685763
Synonyms: 2- hydroxy- 7- propyl- 7,8- dihydro- 5H- pyrano[4,3- b]pyridine- 3- carboxylicacid
Smiles: CCCC1Cc2nc(O)c(cc2CO1)C(=O)O

STK780549
Synonyms: 7- ethyl- 2- hydroxy- 7- methyl- 7,8- dihydro- 5H- pyrano[4,3- b]pyridine- 3- carbonitrile
Smiles: CCC1(C)OCc2c(C1)nc(c(c2)C#N)O

STK780550
Synonyms: 2- hydroxy- 7- (propan- 2- yl)- 7,8- dihydro- 5H- pyrano[4,3- b]pyridine- 3- carbonitrile
Smiles: N#Cc1cc2COC(Cc2nc1O)C(C)C

STK685764
Synonyms: 5- amino- 1- (pentan- 3- yl)- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: CCC(n1[nH]c(=O)cc1N)CC

STK685765
Synonyms: 5- amino- 1- cycloheptyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: Nc1cc(=O)[nH]n1C1CCCCCC1

STK780551
Synonyms: (1R,2R,5S)- 2- {4- ethyl- 3- [(5- phenyl- 2H- tetrazol- 2- yl)methyl]- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 1- yl}- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: CCn1c(Cn2nnc(n2)c2ccccc2)nn(c1=S)[C@@H]1CC(=O)[C@@H]2O[C@H]1CO2

STK780555
Synonyms: methyl(4- oxo- 1,2,3,4- tetrahydro- 5H- cyclopenta[c]quinolin- 5- yl)acetate
Smiles: COC(=O)Cn1c(=O)c2CCCc2c2c1cccc2

STK685769
Synonyms: N- benzyl- 4- hydroxy- 2- oxo- 3- phenyl- 1,2- dihydroquinoline- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)c(O)c(c(=O)[nH]2)c1ccccc1)NCc1ccccc1

STK685770
Synonyms: 1'- (2- chlorobenzyl)spiro[1,3- dioxepane- 2,3'- indol]- 2'(1'H)- one
Smiles: Clc1ccccc1CN1c2ccccc2C2(C1=O)OCCCCO2

STK685771
Synonyms: 7,8- dimethoxy- 1- oxo- 1H- isothiochromene- 3- carboxylicacid
Smiles: COc1c(OC)ccc2c1c(=O)sc(c2)C(=O)O

STK685772
Synonyms: N- [(7,8- dimethoxy- 1- oxo- 1H- isothiochromen- 3- yl)carbonyl]glycine
Smiles: COc1c(OC)ccc2c1c(=O)sc(c2)C(=O)NCC(=O)O

STK685773
Synonyms: 10- methyl- 2,6- dioxo- 3,5a,6,11b- tetrahydro- 2H,5H- chromeno[4',3':4,5]thiopyrano[2,3- d][1,3]thiazole- 5- carboxylicacid
Smiles: O=C1Oc2ccc(cc2C2C1C(Sc1c2sc(=O)[nH]1)C(=O)O)C

STK685775
Synonyms: (10- methyl- 2,6- dioxo- 3,11b- dihydro- 2H,5H- chromeno[4',3':4,5]thiopyrano[2,3- d][1,3]thiazol- 5a(6H)- yl)aceticacid
Smiles: OC(=O)CC12CSc3c(C2c2c(OC1=O)ccc(c2)C)sc(=O)[nH]3

STK780559
Synonyms: 9- (pyridin- 3- yl)- 3,4a,5,6,7,8,8a,9- octahydro- 2H- 5,8- methanothiochromeno[2,3- d][1,3]thiazol- 2- one
Smiles: O=c1sc2c([nH]1)SC1C(C2c2cccnc2)C2CCC1C2

STK685776
Synonyms: 8,10- dibromo- 5a- methyl- 3,5a,6,11b- tetrahydro- 2H,5H- chromeno[4',3':4,5]thiopyrano[2,3- d][1,3]thiazol- 2- one
Smiles: Brc1cc(Br)c2c(c1)C1c3sc(=O)[nH]c3SCC1(CO2)C

STK685777
Synonyms: [4- (3,5- dichloropyridin- 2- yl)piperazin- 1- yl](3,4- dimethoxyphenyl)methanone
Smiles: COc1cc(ccc1OC)C(=O)N1CCN(CC1)c1ncc(cc1Cl)Cl

STK780562
Synonyms: (3,4- dimethoxyphenyl){4- [4- nitro- 2- (trifluoromethyl)phenyl]piperazin- 1- yl}methanone
Smiles: COc1ccc(cc1OC)C(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)[N+](=O)[O-]

STK780568
Synonyms: [4- (3,5- dichloropyridin- 2- yl)piperazin- 1- yl](3,4,5- trimethoxyphenyl)methanone
Smiles: COc1cc(cc(c1OC)OC)C(=O)N1CCN(CC1)c1ncc(cc1Cl)Cl

STK685778
Synonyms: 4- (8- acetyl- 3- oxo- 1,2,4,8- tetraazaspiro[4.5]dec- 2- yl)benzoicacid
Smiles: CC(=O)N1CCC2(CC1)NN(C(=O)N2)c1ccc(cc1)C(=O)O

STK780571
Synonyms: (8- methoxy- 2,6- dioxo- 3,11b- dihydro- 2H,5H- chromeno[4',3':4,5]thiopyrano[2,3- d][1,3]thiazol- 5a(6H)- yl)aceticacid
Smiles: COc1cccc2c1OC(=O)C1(C2c2sc(=O)[nH]c2SC1)CC(=O)O

STK780572
Synonyms: dimethyl2- oxo- 7- (thiophen- 2- yl)- 3,7- dihydro- 2H- thiopyrano[2,3- d][1,3]thiazole- 5,6- dicarboxylate
Smiles: COC(=O)C1=C(C(=O)OC)C(c2c(S1)[nH]c(=O)s2)c1cccs1

STK780574
Synonyms: N- (1- acetyl- 8- oxo- 4,6- dithia- 1,2,9- triazaspiro[4.4]non- 2- en- 3- yl)acetamide
Smiles: CC(=O)NC1=NN(C2(S1)SCC(=O)N2)C(=O)C

STK685780
Synonyms: 3- [(7Z)- 6- oxo- 7- (2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)- 6,7- dihydro- 2H- [1,3]thiazolo[3,2- a][1,3,5]triazin- 3(4H)- yl]benzoicacid
Smiles: O=C1Nc2c(/C/1=c\1/sc3=NCN(Cn3c1=O)c1cccc(c1)C(=O)O)cccc2

STK685782
Synonyms: 4'- (4- chlorophenyl)- 5- fluoro- 3''- (4- methoxybenzyl)- 1'- methyl- 2''- thioxo- 4''H- dispiro[indole- 3,2'- pyrrolidine- 3',5''- [1,3]thiazolidine]- 2,4''(1H)- dione
Smiles: COc1ccc(cc1)CN1C(=S)SC2(C1=O)C(CN(C12C(=O)Nc2c1cc(F)cc2)C)c1ccc(cc1)Cl

STK780575
Synonyms: 1,3- dimethyl- 5- phenyl- 6- (pyridin- 2- yl)- 1H- pyrrolo[3,4- d]pyrimidine- 2,4(3H,6H)- dione
Smiles: Cn1c2cn(c(c2c(=O)n(c1=O)C)c1ccccc1)c1ccccn1

STK685783
Synonyms: 3- (furan- 2- yl)- 3- [(furan- 2- ylcarbonyl)amino]propanoicacid
Smiles: OC(=O)CC(c1ccco1)NC(=O)c1ccco1

STK685784
Synonyms: 3- {[(4- chlorophenyl)acetyl]amino}- 3- (furan- 2- yl)propanoicacid
Smiles: O=C(NC(c1ccco1)CC(=O)O)Cc1ccc(cc1)Cl

STK780580
Synonyms: 4- [(2- hydroxybenzyl)amino]- 1H- pyrazole- 3- carboxamide
Smiles: Oc1ccccc1CNc1c[nH]nc1C(=O)N

STK780582
Synonyms: 2- [(1H- benzotriazol- 4- ylamino)methyl]phenol
Smiles: Oc1ccccc1CNc1cccc2c1nn[nH]2

STK780583
Synonyms: 2- [(1H- benzotriazol- 4- ylamino)methyl]- 4- bromophenol
Smiles: Brc1ccc(c(c1)CNc1cccc2c1nn[nH]2)O

STK780584
Synonyms: 3- (furan- 2- ylmethyl)- 4,5- bis(4- methoxyphenyl)- 1,3- oxazol- 2(3H)- one
Smiles: COc1ccc(cc1)c1c(oc(=O)n1Cc1ccco1)c1ccc(cc1)OC

STK685786
Synonyms: 1- (dimethylamino)- 4- (2,5- dimethylthiophen- 3- yl)- 7,7- dimethyl- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: Cc1cc(c(s1)C)C1CC(=O)N(C2=C1C(=O)CC(C2)(C)C)N(C)C

STK780585
Synonyms: ethyl5- amino- 6- cyano- 7- (5- ethylthiophen- 2- yl)- 2- methyl- 7H- thieno[3,2- b]pyran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)sc2c1OC(=C(C2c1ccc(s1)CC)C#N)N

STK780586
Synonyms: ethyl5- amino- 6- cyano- 2- methyl- 7- (5- methylthiophen- 2- yl)- 7H- thieno[3,2- b]pyran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)sc2c1OC(=C(C2c1ccc(s1)C)C#N)N

STK780593
Synonyms: 4- (5- methoxy- 1H- indol- 3- yl)- 6- methyl- 4,6- dihydro- 2H- pyrano[3,2- c]quinoline- 2,5(3H)- dione
Smiles: COc1ccc2c(c1)c(c[nH]2)C1CC(=O)Oc2c1c(=O)n(c1c2cccc1)C

STK685790
Synonyms: ethyl7- (furan- 2- yl)- 4- (3- methoxyphenyl)- 2,5- dioxo- 1,2,3,4,5,6,7,8- octahydroquinoline- 6- carboxylate
Smiles: CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)c1cccc(c1)OC)c1ccco1

STK685791
Synonyms: ethyl7- (furan- 2- yl)- 4- (4- hydroxy- 3- methoxyphenyl)- 2,5- dioxo- 1,2,3,4,5,6,7,8- octahydroquinoline- 6- carboxylate
Smiles: CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)c1ccc(c(c1)OC)O)c1ccco1

STK685792
Synonyms: ethyl4- (3,4- dimethoxyphenyl)- 2,5- dioxo- 7- (thiophen- 2- yl)- 1,2,3,4,5,6,7,8- octahydroquinoline- 6- carboxylate
Smiles: CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)c1ccc(c(c1)OC)OC)c1cccs1

STK685793
Synonyms: ethyl7- (furan- 2- yl)- 2,5- dioxo- 4- (3,4,5- trimethoxyphenyl)- 1,2,3,4,5,6,7,8- octahydroquinoline- 6- carboxylate
Smiles: CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)c1cc(OC)c(c(c1)OC)OC)c1ccco1

STK780599
Synonyms: 3- (4- chlorophenyl)- 4- (3- fluorophenyl)- 1,4,5,7- tetrahydro- 6H- pyrazolo[3,4- b]pyridin- 6- one
Smiles: O=C1CC(c2cccc(c2)F)c2c(N1)[nH]nc2c1ccc(cc1)Cl

STK780602
Synonyms: 3- (4- chlorophenyl)- 4- (3- methylthiophen- 2- yl)- 1,4,5,7- tetrahydro- 6H- pyrazolo[3,4- b]pyridin- 6- one
Smiles: O=C1CC(c2sccc2C)c2c(N1)[nH]nc2c1ccc(cc1)Cl

STK780604
Synonyms: 7- methyl- 4- phenyl- 3,4- dihydro- 2H- dipyrido[1,2- a:3',2'- e]pyrimidine- 2,5(1H)- dione
Smiles: O=C1CC(c2ccccc2)c2c(N1)n1cccc(c1nc2=O)C

STK780605
Synonyms: 7,7- dimethyl- 5- oxo- 2- (1H- pyrrol- 1- yl)- 4- (thiophen- 2- yl)- 1- [3- (trifluoromethyl)phenyl]- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccs1)C(=O)CC(C2)(C)C)c1cccc(c1)C(F)(F)F

STK685794
Synonyms: 6- (3- methoxyphenyl)- 6,9- dihydropyrido[3,2- e][1,2,4]triazolo[1,5- a]pyrimidine- 5,8(4H,7H)- dione
Smiles: COc1cccc(c1)C1CC(=O)Nc2c1c(=O)[nH]c1n2ncn1

STK780606
Synonyms: 4- (3- methylphenyl)- 3,4- dihydro- 2H- pyrido[3,2- e][1,3]thiazolo[3,2- a]pyrimidine- 2,5(1H)- dione
Smiles: O=C1CC(c2cccc(c2)C)c2c(N1)n1ccsc1nc2=O

STK780608
Synonyms: 3- [2- (6,7- dichloro- 2- methyl- 1H- indol- 3- yl)ethyl]- 4- hydroxy- 4,5,5- trimethyl- 1,3- oxazolidin- 2- one
Smiles: O=C1OC(C(N1CCc1c(C)[nH]c2c1ccc(c2Cl)Cl)(C)O)(C)C

STK780609
Synonyms: N- (3- fluorophenyl)- 3- (4- hydroxy- 4- methyl- 2- oxo- 1- oxa- 3- azaspiro[4.5]dec- 3- yl)propanamide
Smiles: O=C(Nc1cccc(c1)F)CCN1C(=O)OC2(C1(C)O)CCCCC2

STK780610
Synonyms: 2- (4- hydroxy- 4,5,5- trimethyl- 2- oxo- 1,3- oxazolidin- 3- yl)- N- phenylacetamide
Smiles: O=C(Nc1ccccc1)CN1C(=O)OC(C1(C)O)(C)C

STK780615
Synonyms: 5- amino- N- (4- fluorophenyl)- 2H- 1,2,3- triazole- 4- carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1n[nH]nc1N

STK780617
Synonyms: 1- (2- phenylethyl)- 6- propyl- 2- thioxo- 2,3,5,6,7,8- hexahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: CCCN1CNc2c(C1)c(=O)[nH]c(=S)n2CCc1ccccc1

STK685795
Synonyms: 8- methyl- 3- (2- phenylethyl)- 1,2,3,4,8,9- hexahydro- 5H- pyrimido[5,4- e][1,3]thiazolo[3,2- a]pyrimidin- 5- one
Smiles: CC1Cn2c(S1)nc(=O)c1c2NCN(C1)CCc1ccccc1

STK780618
Synonyms: 3- [3- (1H- benzimidazol- 1- yl)propyl]- 4- hydroxy- 4,5,5- trimethyl- 1,3- oxazolidin- 2- one
Smiles: O=C1OC(C(N1CCCn1cnc2c1cccc2)(C)O)(C)C

STK780621
Synonyms: 1,6- bis(furan- 2- ylmethyl)- 2- thioxo- 2,3,5,6,7,8- hexahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: O=c1[nH]c(=S)n(c2c1CN(CN2)Cc1ccco1)Cc1ccco1

STK685800
Synonyms: 4- [8- acetyl- 9- (4- chlorophenyl)- 7- methyl- 4- oxopyrido[3',2':4,5]thieno[3,2- d][1,2,3]triazin- 3(4H)- yl]- N- (pyrimidin- 2- yl)benzenesulfonamide
Smiles: Clc1ccc(cc1)c1c(C(=O)C)c(C)nc2c1c1nnn(c(=O)c1s2)c1ccc(cc1)S(=O)(=O)Nc1ncccn1

STK685801
Synonyms: 5- {[4- (furan- 2- ylcarbonyl)piperazin- 1- yl]sulfonyl}- 1- methyl- 1,3- dihydro- 2H- indol- 2- one
Smiles: O=C1Cc2c(N1C)ccc(c2)S(=O)(=O)N1CCN(CC1)C(=O)c1ccco1

STK780623
Synonyms: methyl2- {[4- (1H- benzimidazol- 2- ylsulfanyl)- 3- nitrophenyl]carbonyl}benzoate
Smiles: COC(=O)c1ccccc1C(=O)c1ccc(c(c1)[N+](=O)[O-])Sc1nc2c([nH]1)cccc2

STK780625
Synonyms: N- [4- (2H- benzotriazol- 2- yl)phenyl]- N- (propan- 2- yl)furan- 2- carboxamide
Smiles: CC(N(C(=O)c1ccco1)c1ccc(cc1)n1nc2c(n1)cccc2)C

STK685803
Synonyms: N- phenyltetrazolo[1,5- a]quinoxalin- 4- amine
Smiles: c1ccc(cc1)Nc1nc2ccccc2n2c1nnn2

STK780632
Synonyms: 4- methylidene- 3- [2- (pyridin- 2- yl)ethyl]- 1- oxa- 3- azaspiro[4.5]decan- 2- one
Smiles: O=C1OC2(C(=C)N1CCc1ccccn1)CCCCC2

STK780633
Synonyms: ethyl4- (4- ethylphenyl)- 2,5- dioxo- 7- (thiophen- 2- yl)- 1,2,3,4,5,6,7,8- octahydroquinoline- 6- carboxylate
Smiles: CCOC(=O)C1C(=O)C2=C(CC1c1cccs1)NC(=O)CC2c1ccc(cc1)CC

STK685809
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 3- [(tricyclo[3.3.1.1~3,7~]dec- 1- ylcarbonyl)amino]propanoicacid
Smiles: OC(=O)CC(c1ccc2c(c1)OCO2)NC(=O)C12CC3CC(C2)CC(C1)C3

STK685811
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 3- {[(2,4- dichlorophenyl)carbonyl]amino}propanoicacid
Smiles: OC(=O)CC(c1ccc2c(c1)OCO2)NC(=O)c1ccc(cc1Cl)Cl

STK685812
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 3- {[(4- methylphenyl)carbonyl]amino}propanoicacid
Smiles: OC(=O)CC(c1ccc2c(c1)OCO2)NC(=O)c1ccc(cc1)C

STK685814
Synonyms: 3- [5- (4- fluorophenyl)- 1- phenyl- 4,5- dihydro- 1H- pyrazol- 3- yl]- 4,6- dimethylpyridin- 2(1H)- one
Smiles: Fc1ccc(cc1)C1CC(=NN1c1ccccc1)c1c(C)cc([nH]c1=O)C

STK685815
Synonyms: 3- [5- (3,4- dimethoxyphenyl)- 1- phenyl- 4,5- dihydro- 1H- pyrazol- 3- yl]- 4,6- dimethylpyridin- 2(1H)- one
Smiles: COc1ccc(cc1OC)C1CC(=NN1c1ccccc1)c1c(C)cc([nH]c1=O)C

STK780639
Synonyms: 3- [5- (furan- 2- yl)- 1- phenyl- 4,5- dihydro- 1H- pyrazol- 3- yl]- 5,6,7,8- tetrahydroquinolin- 2(1H)- one
Smiles: O=c1[nH]c2CCCCc2cc1C1=NN(C(C1)c1ccco1)c1ccccc1

STK685816
Synonyms: 1- (2- methoxyphenyl)- 7,7- dimethyl- N- (1- methylpiperidin- 4- yl)- 2,5- dioxo- 1,2,5,6,7,8- hexahydroquinoline- 3- carboxamide
Smiles: COc1ccccc1n1c2CC(C)(C)CC(=O)c2cc(c1=O)C(=O)NC1CCN(CC1)C

STK780642
Synonyms: 2- (1H- benzimidazol- 2- ylsulfanyl)- N- (furan- 2- ylmethyl)- 5- nitrobenzamide
Smiles: O=C(c1cc(ccc1Sc1nc2c([nH]1)cccc2)[N+](=O)[O-])NCc1ccco1

STK780646
Synonyms: 2- {[6- methyl- 2- (methylsulfanyl)pyrimidin- 4- yl]oxy}- N- [2- (4- methylphenoxy)ethyl]acetamide
Smiles: CSc1nc(OCC(=O)NCCOc2ccc(cc2)C)cc(n1)C

STK780648
Synonyms: N- [(3,6- dichloro- 2- methoxyphenyl)carbonyl]morpholine- 4- carboxamide
Smiles: COc1c(Cl)ccc(c1C(=O)NC(=O)N1CCOCC1)Cl

STK780655
Synonyms: N- (3,4- dichlorophenyl)- 2- {[4- (methylamino)- 6- (morpholin- 4- yl)- 1,3,5- triazin- 2- yl]sulfanyl}propanamide
Smiles: CNc1nc(SC(C(=O)Nc2ccc(c(c2)Cl)Cl)C)nc(n1)N1CCOCC1

STK780659
Synonyms: 6- {[4- (tert- butylamino)- 6- (morpholin- 4- yl)- 1,3,5- triazin- 2- yl]oxy}- 2- phenylpyridazin- 3(2H)- one
Smiles: O=c1ccc(nn1c1ccccc1)Oc1nc(nc(n1)N1CCOCC1)NC(C)(C)C

STK780663
Synonyms: 6- ({4- [(2- methylpropyl)amino]- 6- (morpholin- 4- yl)- 1,3,5- triazin- 2- yl}oxy)- 2- phenylpyridazin- 3(2H)- one
Smiles: CC(CNc1nc(Oc2ccc(=O)n(n2)c2ccccc2)nc(n1)N1CCOCC1)C

STK780670
Synonyms: [1,3]thiazolo[5,4- e][2,1,3]benzothiadiazol- 7- amine
Smiles: Nc1nc2c(s1)c1nsnc1cc2

STK780671
Synonyms: 2- methyl- 6- ({4- [(2- methylpropyl)amino]- 6- (morpholin- 4- yl)- 1,3,5- triazin- 2- yl}oxy)pyridazin- 3(2H)- one
Smiles: CC(CNc1nc(Oc2ccc(=O)n(n2)C)nc(n1)N1CCOCC1)C

STK780674
Synonyms: 2- {[(4E)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylideneamino]oxy}- N- (2- fluorophenyl)acetamide
Smiles: O=C(Nc1ccccc1F)CO/N=C/1\CCCc2c1non2

STK780684
Synonyms: N- (3- cyano- 6- methyl- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)- 2- {5- [4- (trifluoromethyl)phenyl]- 2H- tetrazol- 2- yl}acetamide
Smiles: N#Cc1c(NC(=O)Cn2nnc(n2)c2ccc(cc2)C(F)(F)F)sc2c1CCC(C2)C

STK780686
Synonyms: 1- (3- chlorobenzyl)- 3- nitropyridin- 2(1H)- one
Smiles: Clc1cccc(c1)Cn1cccc(c1=O)[N+](=O)[O-]

STK780693
Synonyms: N- cycloheptyl- 2- {[4- (morpholin- 4- yl)- 1,2,5- thiadiazol- 3- yl]oxy}acetamide
Smiles: O=C(NC1CCCCCC1)COc1nsnc1N1CCOCC1

STK685830
Synonyms: 4,7- diamino- 5- (2,6- dichlorophenyl)- 2- (ethylsulfanyl)- 5H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: CCSc1nc(N)c2c(n1)OC(=C(C2c1c(Cl)cccc1Cl)C#N)N

STK780697
Synonyms: 2- amino- 5- oxo- 4- (pyridin- 3- yl)- 5H- pyrido[3,2- e][1,3]thiazolo[3,2- a]pyrimidine- 3- carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1cccnc1)c(=O)nc1n2ccs1

STK685832
Synonyms: 3- (2,4- dichlorophenyl)- 3- [(furan- 2- ylcarbonyl)amino]propanoicacid
Smiles: OC(=O)CC(c1ccc(cc1Cl)Cl)NC(=O)c1ccco1

STK780698
Synonyms: 1- [4- (cyclopentyloxy)- 3- methoxyphenyl]- 6- methoxy- 2,3,4,9- tetrahydro- 1H- beta- carboline
Smiles: COc1cc(ccc1OC1CCCC1)C1NCCc2c1[nH]c1c2cc(cc1)OC

STK685834
Synonyms: 1- {2- [(2- chloropyridin- 3- yl)amino]- 2- oxoethyl}piperidine- 4- carboxamide
Smiles: O=C(Nc1cccnc1Cl)CN1CCC(CC1)C(=O)N

STK685835
Synonyms: 6- (butylsulfanyl)- 3,4- dihydro- 2H- 1,4- ethano- 1,5- naphthyridine- 7- carbonitrile
Smiles: CCCCSc1nc2C3CCN(c2cc1C#N)CC3

STK685837
Synonyms: 2- [(7- cyano- 3,4- dihydro- 2H- 1,4- ethano- 1,5- naphthyridin- 6- yl)sulfanyl]- N- (4- fluorophenyl)acetamide
Smiles: N#Cc1cc2N3CCC(c2nc1SCC(=O)Nc1ccc(cc1)F)CC3

STK685838
Synonyms: [6- bromo- 5- methoxy- 1- methyl- 2- (morpholin- 4- ylmethyl)- 1H- indol- 3- yl](morpholin- 4- yl)methanone
Smiles: COc1cc2c(C(=O)N3CCOCC3)c(n(c2cc1Br)C)CN1CCOCC1

STK780705
Synonyms: ethyl6- bromo- 1- butyl- 5- hydroxy- 2- methyl- 4- (morpholin- 4- ylmethyl)- 1H- indole- 3- carboxylate
Smiles: CCCCn1c(C)c(c2c1cc(Br)c(c2CN1CCOCC1)O)C(=O)OCC

STK685840
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (4- ethoxy- 3- methoxyphenyl)- 1H- 1,2,3- triazole- 4- carboxylicacid
Smiles: CCOc1ccc(cc1OC)c1c(nnn1c1nonc1N)C(=O)O

STK780710
Synonyms: 4- (2- ethoxyphenyl)- 3- phenyl- 1,4,5,7- tetrahydro- 6H- pyrazolo[3,4- b]pyridin- 6- one
Smiles: CCOc1ccccc1C1CC(=O)Nc2c1c(n[nH]2)c1ccccc1

STK780719
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 1- (3- methylphenyl)- 5- oxo- 2- (1H- pyrrol- 1- yl)- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1cccc(c1)C

STK685842
Synonyms: 6- (2,5- dimethoxyphenyl)- 6,9- dihydropyrido[3,2- e][1,2,4]triazolo[1,5- a]pyrimidine- 5,8(4H,7H)- dione
Smiles: COc1ccc(cc1C1CC(=O)Nc2c1c(=O)[nH]c1n2ncn1)OC

STK780736
Synonyms: 2- chlorobenzyl4- [2- (4- fluorobenzyl)- 2H- tetrazol- 5- yl]benzoate
Smiles: Fc1ccc(cc1)Cn1nnc(n1)c1ccc(cc1)C(=O)OCc1ccccc1Cl

STK780738
Synonyms: N- (2- fluorobenzyl)- 2- [4- (4- methylphenyl)- 2- (propan- 2- yl)tetrahydro- 2H- pyran- 4- yl]ethanamine
Smiles: CC(C1OCCC(C1)(CCNCc1ccccc1F)c1ccc(cc1)C)C

STK685843
Synonyms: 4- (6- methoxy- 1H- indol- 3- yl)- 1,4- dihydro[1,3,5]triazino[1,2- a]benzimidazol- 2- amine
Smiles: COc1ccc2c(c1)[nH]cc2C1N=C(N)Nc2n1c1ccccc1n2

STK685844
Synonyms: 2- [4- (2- amino- 1,4- dihydro[1,3,5]triazino[1,2- a]benzimidazol- 4- yl)- 2- methoxyphenoxy]acetamide
Smiles: COc1cc(ccc1OCC(=O)N)C1N=C(N)Nc2n1c1ccccc1n2

STK780739
Synonyms: 2- (4- hydroxy- 4- methyl- 2- oxo- 1- oxa- 3- azaspiro[4.5]dec- 3- yl)- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(CN1C(=O)OC2(C1(C)O)CCCCC2)Nc1cccc(c1)C(F)(F)F

STK780740
Synonyms: 2- (4- hydroxy- 4,5,5- trimethyl- 2- oxo- 1,3- oxazolidin- 3- yl)- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(CN1C(=O)OC(C1(C)O)(C)C)Nc1cccc(c1)C(F)(F)F

STK780741
Synonyms: N- [2- (pyrimidin- 2- ylsulfanyl)acetyl]benzamide
Smiles: O=C(NC(=O)c1ccccc1)CSc1ncccn1

STK780742
Synonyms: 4- hydroxy- 3- [2- (1H- imidazol- 5- yl)ethyl]- 4,5,5- trimethyl- 1,3- oxazolidin- 2- one
Smiles: O=C1OC(C(N1CCc1[nH]cnc1)(C)O)(C)C

STK685847
Synonyms: 4- (2- amino- 1,4- dihydro[1,3,5]triazino[1,2- a]benzimidazol- 4- yl)- 3,5- dimethyl- 1H- pyrrole- 2- carbonitrile
Smiles: N#Cc1[nH]c(c(c1C)C1N=C(N)Nc2n1c1ccccc1n2)C

STK780743
Synonyms: 4- (4- nitro- 1H- pyrazol- 1- yl)- N- [5- (2- phenylethyl)- 1,3,4- thiadiazol- 2- yl]butanamide
Smiles: O=C(Nc1nnc(s1)CCc1ccccc1)CCCn1ncc(c1)[N+](=O)[O-]

STK780746
Synonyms: 1- (azepan- 1- yl)- 2- (4- nitro- 1H- pyrazol- 1- yl)propan- 1- one
Smiles: CC(n1ncc(c1)[N+](=O)[O-])C(=O)N1CCCCCC1

STK780749
Synonyms: N- (4,6- dimethylpyrimidin- 2- yl)- 2- (4- nitro- 1H- pyrazol- 1- yl)propanamide
Smiles: CC(n1ncc(c1)[N+](=O)[O-])C(=O)Nc1nc(C)cc(n1)C

STK780750
Synonyms: N- [2- (1H- indol- 3- yl)ethyl]- 2- (4- nitro- 1H- pyrazol- 1- yl)propanamide
Smiles: O=C(C(n1ncc(c1)[N+](=O)[O-])C)NCCc1c[nH]c2c1cccc2

STK780756
Synonyms: 4- (3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)- 1- (piperidin- 1- yl)butan- 1- one
Smiles: O=C(N1CCCCC1)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK780757
Synonyms: 3- (3- methoxyphenyl)- N- (2- phenylethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: COc1cccc(c1)c1noc(n1)C(=O)NCCc1ccccc1

STK780769
Synonyms: N- (2,1,3- benzoxadiazol- 4- yl)- 2- (3- chlorophenoxy)acetamide
Smiles: O=C(Nc1cccc2c1non2)COc1cccc(c1)Cl

STK780770
Synonyms: N- (2,1,3- benzoxadiazol- 4- yl)- 5- chloro- 2- methoxybenzamide
Smiles: COc1ccc(cc1C(=O)Nc1cccc2c1non2)Cl

STK780771
Synonyms: N- (2,1,3- benzoxadiazol- 4- yl)- 3- nitrobenzamide
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])Nc1cccc2c1non2

STK780775
Synonyms: 7- (2- fluorobenzyl)- 10- methoxy- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 6(7H)- one
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2Cc1ccccc1F

STK780776
Synonyms: 2,6- dimethyl- 11H- indeno[1,2- b]quinoline
Smiles: Cc1ccc2c(c1)Cc1c2nc2c(c1)cccc2C

STK685854
Synonyms: 4- {(E)- [2- (3- phenyl[1,2,4]triazolo[4,3- b]pyridazin- 6- yl)hydrazinylidene]methyl}benzene- 1,2- diol
Smiles: Oc1ccc(cc1O)/C=N/Nc1ccc2n(n1)c(nn2)c1ccccc1

STK685855
Synonyms: 6- (3- fluorophenyl)- 5- (4- methylphenyl)- 7- phenyl- 2,3,6,7- tetrahydropyrrolo[3,4- e][1,4]diazepin- 8(1H)- one
Smiles: Fc1cccc(c1)C1C2=C(C(=O)N1c1ccccc1)NCCN=C2c1ccc(cc1)C

STK780777
Synonyms: 5- (4- chlorophenyl)- 7- (4- ethoxyphenyl)- 6- (pyridin- 3- yl)- 2,3,6,7- tetrahydropyrrolo[3,4- e][1,4]diazepin- 8(1H)- one
Smiles: CCOc1ccc(cc1)N1C(=O)C2=C(C1c1cccnc1)C(=NCCN2)c1ccc(cc1)Cl

STK780779
Synonyms: 7- (4- bromophenyl)- 5- (4- chlorophenyl)- 6- (pyridin- 3- yl)- 2,3,6,7- tetrahydropyrrolo[3,4- e][1,4]diazepin- 8(1H)- one
Smiles: Clc1ccc(cc1)C1=NCCNC2=C1C(c1cccnc1)N(C2=O)c1ccc(cc1)Br

STK685857
Synonyms: 1- (5- chloro- 2- methoxyphenyl)- 4- (4- chlorophenyl)- 1H- 1,2,3- triazol- 5- amine
Smiles: COc1ccc(cc1n1nnc(c1N)c1ccc(cc1)Cl)Cl

STK780781
Synonyms: 3- hydroxy- 5- (pyridin- 3- yl)- 4- (thiophen- 2- ylcarbonyl)- 1,5- dihydro- 2H- pyrrol- 2- one
Smiles: O=C1NC(C(=C1O)C(=O)c1cccs1)c1cccnc1

STK780783
Synonyms: 2- (8,9- dimethoxy- 5- oxo- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 6(5H)- yl)acetamide
Smiles: COc1cc2c(cc1OC)n(c1c2nc2SCCn2c1=O)CC(=O)N

STK780785
Synonyms: 9,10- dimethoxy- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 6(7H)- one
Smiles: COc1cc2c(cc1OC)[nH]c1c2nc2SCCCn2c1=O

STK780786
Synonyms: 5- amino- 3- [(4- methoxyphenyl)amino]- 1H- pyrazole- 4- carboxamide
Smiles: COc1ccc(cc1)Nc1n[nH]c(c1C(=O)N)N

STK780787
Synonyms: (2Z)- 2- [(1S,2S,5R)- 2- (4- ethyl- 3- {[5- (4- methylphenyl)- 2H- tetrazol- 2- yl]methyl}- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 1- yl)- 6,8- dioxabicyclo[3.2.1]oct- 4- ylidene]hydrazinecarbothioamide(non- preferredna
Smiles: CCn1c(Cn2nnc(n2)c2ccc(cc2)C)nn(c1=S)[C@H]1C/C(=N/NC(=S)N)/[C@H]2O[C@@H]1CO2

STK685861
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 3- {[(2- fluorophenyl)carbonyl]amino}propanoicacid
Smiles: OC(=O)CC(c1ccc2c(c1)OCO2)NC(=O)c1ccccc1F

STK780791
Synonyms: N- (5- chloro- 2- methylphenyl)- 4- (4- nitro- 1H- pyrazol- 1- yl)butanamide
Smiles: O=C(Nc1cc(Cl)ccc1C)CCCn1ncc(c1)[N+](=O)[O-]

STK780793
Synonyms: 4- (3,5- dimethyl- 4- nitro- 1H- pyrazol- 1- yl)- N- [3- (trifluoromethyl)phenyl]butanamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CCCn1nc(c(c1C)[N+](=O)[O-])C

STK685865
Synonyms: N- [4- (cyanomethyl)phenyl]- 2- (4- iodo- 1H- pyrazol- 1- yl)acetamide
Smiles: N#CCc1ccc(cc1)NC(=O)Cn1ncc(c1)I

STK685866
Synonyms: N- (4- cyanophenyl)- 2- (4- iodo- 1H- pyrazol- 1- yl)acetamide
Smiles: N#Cc1ccc(cc1)NC(=O)Cn1ncc(c1)I

STK685875
Synonyms: N- (3,4- difluorophenyl)- 2- (4- iodo- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1ncc(c1)I)Nc1ccc(c(c1)F)F

STK685876
Synonyms: 2- (4- iodo- 3,5- dimethyl- 1H- pyrazol- 1- yl)- 1- (morpholin- 4- yl)ethanone
Smiles: O=C(N1CCOCC1)Cn1nc(c(c1C)I)C

STK780806
Synonyms: 3- [(4- bromo- 3,5- dimethyl- 1H- pyrazol- 1- yl)methyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: NC(=O)c1onc(n1)Cn1nc(c(c1C)Br)C

STK685878
Synonyms: 3- (1,3- benzodioxol- 5- yl)- N- (furan- 2- ylmethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)c1ccc2c(c1)OCO2)NCc1ccco1

STK780808
Synonyms: 3- (1,3- benzodioxol- 5- yl)- N- (tetrahydrofuran- 2- ylmethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)c1ccc2c(c1)OCO2)NCC1CCCO1

STK780809
Synonyms: 3- (1,3- benzodioxol- 5- yl)- N- (tricyclo[3.3.1.1~3,7~]dec- 1- ylmethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)c1ccc2c(c1)OCO2)NCC12CC3CC(C2)CC(C1)C3

STK685879
Synonyms: 3- [(4- bromo- 3,5- dimethyl- 1H- pyrazol- 1- yl)methyl]- N- (furan- 2- ylmethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)Cn1nc(c(c1C)Br)C)NCc1ccco1

STK685880
Synonyms: 3- [(4- bromo- 3,5- dimethyl- 1H- pyrazol- 1- yl)methyl]- N- (tetrahydrofuran- 2- ylmethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)Cn1nc(c(c1C)Br)C)NCC1CCCO1

STK780811
Synonyms: 3- [(4- bromo- 3,5- dimethyl- 1H- pyrazol- 1- yl)methyl]- N- (tricyclo[3.3.1.1~3,7~]dec- 1- ylmethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)Cn1nc(c(c1C)Br)C)NCC12CC3CC(C2)CC(C1)C3

STK685882
Synonyms: 2- (5- methyl- 3- nitro- 1H- pyrazol- 1- yl)- N- (6- methylpyridin- 2- yl)acetamide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])Nc1cccc(n1)C

STK780820
Synonyms: N- [2- (1H- indol- 3- yl)ethyl]- 2- (5- methyl- 3- nitro- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])NCCc1c[nH]c2c1cccc2

STK685886
Synonyms: 2- (4- bromo- 5- methyl- 3- nitro- 1H- pyrazol- 1- yl)- 1- (4- chloro- 3,5- dimethyl- 1H- pyrazol- 1- yl)ethanone
Smiles: [O-][N+](=O)c1nn(c(c1Br)C)CC(=O)n1nc(c(c1C)Cl)C

STK780823
Synonyms: 2- (5- methyl- 3- nitro- 1H- pyrazol- 1- yl)- N- (6- nitro- 1,3- benzothiazol- 2- yl)acetamide
Smiles: O=C(Cn1nc(cc1C)[N+](=O)[O-])Nc1nc2c(s1)cc(cc2)[N+](=O)[O-]

STK780825
Synonyms: N- [2- (1H- indol- 3- yl)ethyl]- 2- (4- iodo- 3,5- dimethyl- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)I)C)NCCc1c[nH]c2c1cccc2

STK780829
Synonyms: N- [4- cyano- 5- methyl- 2- oxo- 3- (trifluoromethyl)- 2,3- dihydro- 1H- pyrrol- 3- yl]benzenesulfonamide
Smiles: N#CC1=C(C)NC(=O)C1(NS(=O)(=O)c1ccccc1)C(F)(F)F

STK780831
Synonyms: N- [1- (furan- 2- ylmethyl)- 6,6- dimethyl- 2,4- dioxo- 3- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- indol- 3- yl]furan- 2- carboxamide
Smiles: O=C(c1ccco1)NC1(C2=C(N(C1=O)Cc1ccco1)CC(CC2=O)(C)C)C(F)(F)F

STK780843
Synonyms: 2- methyl- 4- [(4- methylpyridin- 2- yl)amino]- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- pyrrole- 3- carbonitrile
Smiles: N#CC1=C(C)NC(=O)C1(Nc1nccc(c1)C)C(F)(F)F

STK780844
Synonyms: 7,7- dimethyl- 1- (tetrahydrofuran- 2- ylmethyl)- 4,4- bis(trifluoromethyl)- 4,6,7,8- tetrahydroquinazoline- 2,5(1H,3H)- dione
Smiles: O=C1NC(C2=C(N1CC1CCCO1)CC(CC2=O)(C)C)(C(F)(F)F)C(F)(F)F

STK780846
Synonyms: 1- ethyl- N- [4- (1,2- oxazol- 5- yl)phenyl]- 1H- pyrazole- 4- sulfonamide
Smiles: CCn1ncc(c1)S(=O)(=O)Nc1ccc(cc1)c1ccno1

STK780849
Synonyms: 4- chloro- 1- ethyl- N- [3- (trifluoromethyl)phenyl]- 1H- pyrazole- 3- carboxamide
Smiles: CCn1cc(c(n1)C(=O)Nc1cccc(c1)C(F)(F)F)Cl

STK780853
Synonyms: 4- chloro- N- (3,4- dichlorophenyl)- 1- ethyl- 1H- pyrazole- 3- carboxamide
Smiles: CCn1cc(c(n1)C(=O)Nc1ccc(c(c1)Cl)Cl)Cl

STK780855
Synonyms: 4- chloro- N- (3,4- difluorophenyl)- 1- ethyl- 1H- pyrazole- 3- carboxamide
Smiles: CCn1cc(c(n1)C(=O)Nc1ccc(c(c1)F)F)Cl

STK780859
Synonyms: 4- chloro- 1- ethyl- N- [4- (1,2- oxazol- 5- yl)phenyl]- 1H- pyrazole- 3- carboxamide
Smiles: CCn1cc(c(n1)C(=O)Nc1ccc(cc1)c1ccno1)Cl

STK780860
Synonyms: 4- chloro- 1- ethyl- N- [3- (1,2- oxazol- 5- yl)phenyl]- 1H- pyrazole- 3- carboxamide
Smiles: CCn1cc(c(n1)C(=O)Nc1cccc(c1)c1ccno1)Cl

STK780861
Synonyms: N- (2- carbamoylphenyl)- 4- chloro- 1- ethyl- 1H- pyrazole- 3- carboxamide
Smiles: CCn1cc(c(n1)C(=O)Nc1ccccc1C(=O)N)Cl

STK685897
Synonyms: 3- {[(3- fluorophenyl)carbonyl]amino}- 2- hydroxybenzoicacid
Smiles: Fc1cccc(c1)C(=O)Nc1cccc(c1O)C(=O)O

STK685898
Synonyms: 3- {[(4- fluorophenyl)carbonyl]amino}- 2- hydroxybenzoicacid
Smiles: Fc1ccc(cc1)C(=O)Nc1cccc(c1O)C(=O)O

STK685901
Synonyms: 2- (4- chlorophenyl)- 6- iodoimidazo[1,2- a]pyridine
Smiles: Clc1ccc(cc1)c1cn2c(n1)ccc(c2)I

STK780865
Synonyms: 9- nitropyrido[1,2- a]benzimidazole- 7- carboxamide
Smiles: NC(=O)c1cc2nc3n(c2c(c1)[N+](=O)[O-])cccc3

STK685902
Synonyms: 5- fluoro- 3''- (furan- 2- ylmethyl)- 1'- methyl- 2''- thioxo- 4'- (3,4,5- trimethoxyphenyl)- 4''H- dispiro[indole- 3,2'- pyrrolidine- 3',5''- [1,3]thiazolidine]- 2,4''(1H)- dione
Smiles: COc1cc(cc(c1OC)OC)C1CN(C2(C31SC(=S)N(C3=O)Cc1ccco1)C(=O)Nc1c2cc(F)cc1)C

STK685903
Synonyms: 4'- (3,4- dimethoxyphenyl)- 5- fluoro- 3''- (furan- 2- ylmethyl)- 1'- methyl- 2''- thioxo- 4''H- dispiro[indole- 3,2'- pyrrolidine- 3',5''- [1,3]thiazolidine]- 2,4''(1H)- dione
Smiles: COc1cc(ccc1OC)C1CN(C2(C31SC(=S)N(C3=O)Cc1ccco1)C(=O)Nc1c2cc(F)cc1)C

STK685904
Synonyms: 5- chloro- 4'- (3,4- dimethoxyphenyl)- 3''- (furan- 2- ylmethyl)- 1'- methyl- 2''- thioxo- 4''H- dispiro[indole- 3,2'- pyrrolidine- 3',5''- [1,3]thiazolidine]- 2,4''(1H)- dione
Smiles: COc1cc(ccc1OC)C1CN(C2(C31SC(=S)N(C3=O)Cc1ccco1)C(=O)Nc1c2cc(Cl)cc1)C

STK685907
Synonyms: N- {[(4- hydroxypyrimidin- 2- yl)sulfanyl]acetyl}- 4- methylbenzamide
Smiles: O=C(NC(=O)c1ccc(cc1)C)CSc1nccc(n1)O

STK685909
Synonyms: 2- [(2- {[(4- methylphenyl)carbonyl]amino}- 2- oxoethyl)sulfanyl]pyridine- 3- carboxylicacid
Smiles: O=C(NC(=O)c1ccc(cc1)C)CSc1ncccc1C(=O)O

STK685910
Synonyms: 1- {1- [4- (1H- imidazol- 1- yl)phenyl]ethyl}- 3- (4- methylbenzyl)pyrrolidine- 2,5- dione
Smiles: Cc1ccc(cc1)CC1CC(=O)N(C1=O)C(c1ccc(cc1)n1ccnc1)C

STK685913
Synonyms: (3E)- 4- [(5- methoxy- 1,2,3- trimethyl- 1H- indol- 6- yl)amino]pent- 3- en- 2- one
Smiles: COc1cc2c(C)c(n(c2cc1N/C(=C/C(=O)C)/C)C)C

STK780870
Synonyms: 3- [(2- chlorophenyl)carbamoyl]- 2- methylquinoline- 4- carboxylicacid
Smiles: O=C(c1c(C)nc2c(c1C(=O)O)cccc2)Nc1ccccc1Cl

STK780872
Synonyms: 3- (furan- 2- yl)- 6- (4- methoxyphenyl)- 5- thioxotetrahydro- 7H- imidazo[1,5- c][1,3]thiazol- 7- one
Smiles: COc1ccc(cc1)N1C(=S)N2C(C1=O)CSC2c1ccco1

STK685917
Synonyms: N- hydroxy- 3,4,5- trimethoxybenzamide
Smiles: ONC(=O)c1cc(OC)c(c(c1)OC)OC

STK685923
Synonyms: 3- (4- cyclohexylpiperazin- 1- yl)- 1- (5- methyl- 1,2- oxazol- 3- yl)pyrrolidine- 2,5- dione
Smiles: O=C1CC(C(=O)N1c1noc(c1)C)N1CCN(CC1)C1CCCCC1

STK685924
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 3- {[(4- chlorophenyl)carbonyl]amino}propanoicacid
Smiles: OC(=O)CC(c1ccc2c(c1)OCO2)NC(=O)c1ccc(cc1)Cl

STK780876
Synonyms: N,3- dibenzyl- 6- methyl- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidine- 5- sulfonamide
Smiles: O=c1[nH]c(C)c(c(=O)n1Cc1ccccc1)S(=O)(=O)NCc1ccccc1

STK685926
Synonyms: 2- (diethylamino)ethyl6- bromo- 5- methoxy- 2- [(4- methoxyphenoxy)methyl]- 1- methyl- 1H- indole- 3- carboxylate
Smiles: CCN(CCOC(=O)c1c2cc(OC)c(cc2n(c1COc1ccc(cc1)OC)C)Br)CC

STK780877
Synonyms: ethyl3- (2- chlorophenyl)- 3- [({5- [4- (trifluoromethyl)phenyl]- 2H- tetrazol- 2- yl}acetyl)amino]propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)Cn1nnc(n1)c1ccc(cc1)C(F)(F)F

STK780878
Synonyms: 1,3- dimethyl- 5- {(E)- 2- [2- oxo- 6- (trifluoromethyl)- 2,3- dihydropyrimidin- 4- yl]ethenyl}- 1,3- dihydro- 2H- benzimidazol- 2- one
Smiles: O=c1nc(cc([nH]1)/C=C/c1ccc2c(c1)n(C)c(=O)n2C)C(F)(F)F

STK685929
Synonyms: 2- methoxyethyl5- hydroxy- 2- methyl- 1- {2- [4- (2- phenylpropan- 2- yl)phenoxy]ethyl}- 1H- benzo[g]indole- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)n(c2c1cc(O)c1c2cccc1)CCOc1ccc(cc1)C(c1ccccc1)(C)C

STK780879
Synonyms: 2- {[5- (2- chlorobenzyl)- 4- hydroxy- 6- methylpyrimidin- 2- yl]sulfanyl}- N- (2,5- dimethoxyphenyl)acetamide
Smiles: COc1ccc(c(c1)NC(=O)CSc1nc(C)c(c(n1)O)Cc1ccccc1Cl)OC

STK685949
Synonyms: (2E)- 2- {[amino(iminio)methyl]sulfanyl}- 3- (3,3- dimethyl- 3,4- dihydroisoquinolin- 1- yl)prop- 2- enoate
Smiles: [O-]C(=O)/C(=C\C1=NC(C)(C)Cc2c1cccc2)/SC(=[NH2+])N

STK780890
Synonyms: ethyl4- (4- fluorophenyl)- 2,5- dioxo- 7- (thiophen- 2- yl)- 1,2,3,4,5,6,7,8- octahydroquinoline- 6- carboxylate
Smiles: CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)c1ccc(cc1)F)c1cccs1

STK780892
Synonyms: ethyl4- (3- methoxyphenyl)- 2,5- dioxo- 7- (thiophen- 2- yl)- 1,2,3,4,5,6,7,8- octahydroquinoline- 6- carboxylate
Smiles: CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)c1cccc(c1)OC)c1cccs1

STK780893
Synonyms: ethyl4- (3,4- dimethoxyphenyl)- 7- (furan- 2- yl)- 2,5- dioxo- 1,2,3,4,5,6,7,8- octahydroquinoline- 6- carboxylate
Smiles: CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)c1ccc(c(c1)OC)OC)c1ccco1

STK780894
Synonyms: ethyl4- (2,5- dimethoxyphenyl)- 2,5- dioxo- 7- (thiophen- 2- yl)- 1,2,3,4,5,6,7,8- octahydroquinoline- 6- carboxylate
Smiles: CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)c1cc(OC)ccc1OC)c1cccs1

STK780895
Synonyms: ethyl4- (2,5- dimethoxyphenyl)- 7- (furan- 2- yl)- 2,5- dioxo- 1,2,3,4,5,6,7,8- octahydroquinoline- 6- carboxylate
Smiles: CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)c1cc(OC)ccc1OC)c1ccco1

STK780896
Synonyms: ethyl2,5- dioxo- 7- (thiophen- 2- yl)- 4- (3,4,5- trimethoxyphenyl)- 1,2,3,4,5,6,7,8- octahydroquinoline- 6- carboxylate
Smiles: CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)c1cc(OC)c(c(c1)OC)OC)c1cccs1

STK780902
Synonyms: 3- phenyl- 4- (thiophen- 2- yl)- 1,4,5,7- tetrahydro- 6H- pyrazolo[3,4- b]pyridin- 6- one
Smiles: O=C1CC(c2cccs2)c2c(N1)[nH]nc2c1ccccc1

STK780914
Synonyms: methyl6- methoxy- 3- {[(2- oxo- 1,3- benzothiazol- 3(2H)- yl)acetyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)Cn1c(=O)sc3c1cccc3)ccc(c2)OC

STK780915
Synonyms: N- (4- {[(4- methylphenyl)sulfonyl]amino}phenyl)- 2- (2- oxo- 1,3- benzothiazol- 3(2H)- yl)acetamide
Smiles: O=C(Cn1c(=O)sc2c1cccc2)Nc1ccc(cc1)NS(=O)(=O)c1ccc(cc1)C

STK780916
Synonyms: ethyl(2- {[(2- oxo- 1,3- benzothiazol- 3(2H)- yl)acetyl]amino}- 1,3- thiazol- 4- yl)acetate
Smiles: CCOC(=O)Cc1csc(n1)NC(=O)Cn1c(=O)sc2c1cccc2

STK685952
Synonyms: 2- [(3- chloro- 4- fluorophenyl)amino][1,3]thiazolo[4,5- b]pyridine- 5,7- diol
Smiles: Oc1cc(O)c2c(n1)nc(s2)Nc1ccc(c(c1)Cl)F

STK685953
Synonyms: 5,7- dihydroxy- 2- [(4- methoxyphenyl)amino]thieno[3,2- b]pyridine- 3- carbonitrile
Smiles: N#Cc1c(Nc2ccc(cc2)OC)sc2c1nc(O)cc2O

STK780920
Synonyms: benzyl[5- (morpholin- 4- yl)- 2,4- dioxo- 3,4- dihydropyrimidin- 1(2H)- yl]acetate
Smiles: O=C(Cn1cc(N2CCOCC2)c(=O)[nH]c1=O)OCc1ccccc1

STK685955
Synonyms: 1- [(1- phenylethoxy)methyl]- 5- [(2- phenylethyl)amino]pyrimidine- 2,4(1H,3H)- dione
Smiles: CC(c1ccccc1)OCn1cc(NCCc2ccccc2)c(=O)[nH]c1=O

STK685956
Synonyms: 1- [(benzyloxy)methyl]- 5- (4- phenylpiperazin- 1- yl)pyrimidine- 2,4(1H,3H)- dione
Smiles: O=c1[nH]c(=O)n(cc1N1CCN(CC1)c1ccccc1)COCc1ccccc1

STK780923
Synonyms: 2- ({[(Z)- cyano(phenyl)methylidene]amino}oxy)acetamide
Smiles: N#C/C(=N\OCC(=O)N)/c1ccccc1

STK780924
Synonyms: 8- methoxyquinolin- 4(1H)- one
Smiles: COc1cccc2c1[nH]ccc2=O

STK685957
Synonyms: 6,7- difluoroquinolin- 4(1H)- one
Smiles: Fc1cc2c(=O)cc[nH]c2cc1F

STK780926
Synonyms: ethyl4- [4- (cyclopentyloxy)phenyl]- 6- methyl- 2- oxo- 3- (phenylacetyl)- 1,2,3,4- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=O)N(C1c1ccc(cc1)OC1CCCC1)C(=O)Cc1ccccc1

STK780931
Synonyms: 4- tert- butylcyclohexyl5- [(5- ethyl- 1,3,4- thiadiazol- 2- yl)amino]- 5- oxopentanoate
Smiles: CCc1nnc(s1)NC(=O)CCCC(=O)OC1CCC(CC1)C(C)(C)C

STK780935
Synonyms: 6- acetyl- 3- amino- N- (4- chloro- 2- fluorophenyl)- 4- (trifluoromethyl)- 5,6,7,8- tetrahydrothieno[2,3- b][1,6]naphthyridine- 2- carboxamide
Smiles: Clc1ccc(c(c1)F)NC(=O)c1sc2c(c1N)c(c1c(n2)CCN(C1)C(=O)C)C(F)(F)F

STK685959
Synonyms: 6- amino- 2- ({2- oxo- 2- [4- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)piperazin- 1- yl]ethyl}sulfanyl)pyrimidin- 4(3H)- one
Smiles: O=C(N1CCN(CC1)C12CC3CC(C2)CC(C1)C3)CSc1nc(N)cc(=O)[nH]1

STK685960
Synonyms: 2,3- dihydro- 1H- quino[1',8':4,5,6][1,4]oxazino[2,3- b]quinoxaline
Smiles: c1cc2Oc3nc4ccccc4nc3N3c2c(c1)CCC3

STK685961
Synonyms: 6- (1H- indol- 3- yl)- 1- (2- methylpropanoyl)- 3- phenyl- 1,6- dihydro- 1,2,4- triazin- 5(4H)- one
Smiles: CC(C(=O)N1N=C(NC(=O)C1c1c[nH]c2c1cccc2)c1ccccc1)C

STK780943
Synonyms: 5- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 1- phenyl- 1H- tetrazole
Smiles: Cc1nn(c(c1)C)c1nnnn1c1ccccc1

STK780945
Synonyms: ethyl4- [(3- chloro- 4- fluorophenyl)amino]- 6,7- difluoroquinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccc(c(c1)Cl)F)cc(c(c2)F)F

STK685963
Synonyms: ethyl6,7- difluoro- 4- (morpholin- 4- yl)quinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1N1CCOCC1)cc(c(c2)F)F

STK685964
Synonyms: ethyl6,7- difluoro- 4- (4- methylpiperazin- 1- yl)quinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1N1CCN(CC1)C)cc(c(c2)F)F

STK685965
Synonyms: 3- amino- 7- fluoro- 6- (piperidin- 1- yl)quinoxaline- 2- carbonitrile
Smiles: N#Cc1nc2cc(F)c(cc2nc1N)N1CCCCC1

STK780951
Synonyms: (1R,2R,5S)- 2- (4- ethyl- 3- {[5- (4- methylphenyl)- 2H- tetrazol- 2- yl]methyl}- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 1- yl)- 6,8- dioxabicyclo[3.2.1]octan- 4- one(non- preferredname)
Smiles: CCn1c(Cn2nnc(n2)c2ccc(cc2)C)nn(c1=S)[C@@H]1CC(=O)[C@@H]2O[C@H]1CO2

STK780952
Synonyms: (4- iodo- 1H- pyrazol- 1- yl)acetonitrile
Smiles: Ic1cn(nc1)CC#N

STK780953
Synonyms: 2- amino- 4- (5- ethylthiophen- 2- yl)- 6- methyl- 5- oxo- 5,6- dihydro- 4H- pyrano[3,2- c]quinoline- 3- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(s1)CC)c(=O)n(c1c2cccc1)C

STK685969
Synonyms: 3- (thiophen- 2- yl)- 6,7- dihydro- 5H- pyrrolo[1,2- a]imidazole
Smiles: c1csc(c1)c1cnc2n1CCC2

STK685971
Synonyms: ethyl6- (3,4- dimethoxyphenyl)- 3- methyl- 6,7- dihydro- 5H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazine- 7- carboxylate
Smiles: CCOC(=O)C1Sc2nnc(n2NC1c1ccc(c(c1)OC)OC)C

STK780958
Synonyms: 2- [(6,8- dimethyl[1,2,4]triazolo[4,3- b]pyridazin- 3- yl)sulfanyl]- N- (4- ethylphenyl)acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nnc2n1nc(C)cc2C

STK780959
Synonyms: 1,1'- [6- (4- fluorophenyl)- 5H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazine- 5,7- diyl]diethanone
Smiles: Fc1ccc(cc1)c1c(sc2n(n1C(=O)C)cnn2)C(=O)C

STK780960
Synonyms: 6- (3- methoxyphenyl)- 3- methyl- 7H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazine
Smiles: COc1cccc(c1)C1=Nn2c(SC1)nnc2C

STK685973
Synonyms: N- (4- bromophenyl)- 3- (trifluoromethyl)- 7H- [1,2,4]triazolo[3,4- b][1,3,4]thiadiazin- 6- amine
Smiles: Brc1ccc(cc1)NC1=Nn2c(SC1)nnc2C(F)(F)F

STK780963
Synonyms: 2- [(6,8- dimethyl[1,2,4]triazolo[4,3- b]pyridazin- 3- yl)sulfanyl]- N- (1,3- thiazol- 2- yl)acetamide
Smiles: O=C(Nc1nccs1)CSc1nnc2n1nc(C)cc2C

STK780964
Synonyms: 6- (1- methyl- 1H- indol- 3- yl)- 5- oxo- 3- phenyl- 5,6- dihydro- 1,2,4- triazine- 1(4H)- carbaldehyde
Smiles: O=CN1N=C(NC(=O)C1c1cn(c2c1cccc2)C)c1ccccc1

STK780966
Synonyms: 4- [4- (2- amino- 1,3- thiazol- 4- yl)- 5- methyl- 1H- 1,2,3- triazol- 1- yl]- 1,2,5- oxadiazol- 3- amine
Smiles: Nc1scc(n1)c1nnn(c1C)c1nonc1N

STK780977
Synonyms: 2- benzyl- 1- [(4- methylphenyl)sulfonyl]- 4,5- dihydro- 1H- imidazole
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCN=C1Cc1ccccc1

STK780980
Synonyms: 3- (4- chlorophenyl)- 7- phenyl- 5H- [1,2,4]triazolo[3,4- b][1,3]thiazin- 5- one
Smiles: Clc1ccc(cc1)c1nnc2n1c(=O)cc(s2)c1ccccc1

STK780981
Synonyms: 3- benzyl- 7- phenyl- 5H- [1,2,4]triazolo[3,4- b][1,3]thiazin- 5- one
Smiles: O=c1cc(sc2n1c(nn2)Cc1ccccc1)c1ccccc1

STK685978
Synonyms: 5- [(4- benzylpiperidin- 1- yl)methyl]- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidine- 4- carboxylicacid
Smiles: OC(=O)c1[nH]c(=O)[nH]c(=O)c1CN1CCC(CC1)Cc1ccccc1

STK685979
Synonyms: 6- ethoxy- 4- hydroxy- 3- phenylquinolin- 2(1H)- one
Smiles: CCOc1ccc2c(c1)c(O)c(c(=O)[nH]2)c1ccccc1

STK780986
Synonyms: 2- methoxyethyl1- (4- fluorophenyl)- 5- hydroxy- 2- methyl- 1H- indole- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)n(c2c1cc(O)cc2)c1ccc(cc1)F

STK685983
Synonyms: methyl6- (tert- butylsulfamoyl)- 3,4- dihydroquinoline- 1(2H)- carboxylate
Smiles: COC(=O)N1CCCc2c1ccc(c2)S(=O)(=O)NC(C)(C)C

STK780988
Synonyms: 1- benzyl- 3- methyl- 3,4- dihydroquinazolin- 2(1H)- one
Smiles: CN1Cc2ccccc2N(C1=O)Cc1ccccc1

STK780989
Synonyms: 3- iodobenzyl1,2- dimethyl- 4- nitro- 1H- imidazole- 5- carboxylate
Smiles: Ic1cccc(c1)COC(=O)c1c(nc(n1C)C)[N+](=O)[O-]

STK780995
Synonyms: methyl1- (2,6- dichlorobenzyl)- 1H- pyrazole- 3- carboxylate
Smiles: COC(=O)c1ccn(n1)Cc1c(Cl)cccc1Cl

STK780997
Synonyms: methyl1- [2- (cyclohexylamino)- 2- oxoethyl]- 1H- pyrazole- 3- carboxylate
Smiles: COC(=O)c1ccn(n1)CC(=O)NC1CCCCC1

STK781000
Synonyms: N- (3- cyano- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl)- 2- {5- [4- (methylsulfanyl)phenyl]- 2H- tetrazol- 2- yl}acetamide
Smiles: CSc1ccc(cc1)c1nnn(n1)CC(=O)Nc1sc2c(c1C#N)CCC2

STK781001
Synonyms: ethyl3- (4- methoxyphenyl)- 3- ({[5- (2- methylphenyl)- 2H- tetrazol- 2- yl]acetyl}amino)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)OC)NC(=O)Cn1nnc(n1)c1ccccc1C

STK781002
Synonyms: methyl1- (3,4- dichlorobenzyl)- 1H- pyrazole- 3- carboxylate
Smiles: COC(=O)c1ccn(n1)Cc1ccc(c(c1)Cl)Cl

STK781003
Synonyms: N- cycloheptyl- 2- {[(4E)- 6,7- dihydro- 2,1,3- benzoxadiazol- 4(5H)- ylideneamino]oxy}acetamide
Smiles: O=C(NC1CCCCCC1)CO/N=C/1\CCCc2c1non2

STK781004
Synonyms: (2Z)- 2- [(1R,2R,5S)- 2- {4- ethyl- 3- [(5- phenyl- 2H- tetrazol- 2- yl)methyl]- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 1- yl}- 6,8- dioxabicyclo[3.2.1]oct- 4- ylidene]hydrazinecarbothioamide(non- preferredname)
Smiles: CCn1c(Cn2nnc(n2)c2ccccc2)nn(c1=S)[C@@H]1C/C(=N/NC(=S)N)/[C@@H]2O[C@H]1CO2

STK781008
Synonyms: 6- amino- 3- methyl- 4- (4- {[(1- methyl- 1H- tetrazol- 5- yl)sulfanyl]methyl}thiophen- 2- yl)- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1scc(c1)CSc1nnnn1C)c(C)[nH]n2

STK781009
Synonyms: 6- cyclohexyl- 1- (2- phenylethyl)- 2- thioxo- 2,3,5,6,7,8- hexahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: O=c1[nH]c(=S)n(c2c1CN(CN2)C1CCCCC1)CCc1ccccc1

STK685988
Synonyms: 5- amino- 2,2- dimethyl- 2,3- dihydro- 7H- [1,3]thiazolo[3,2- a]pyrimidin- 7- one
Smiles: CC1(C)Sc2n(C1)c(N)cc(=O)n2

STK685989
Synonyms: 3- cyclohexyl- 8,8- dimethyl- 1,2,3,4,8,9- hexahydro- 5H- pyrimido[5,4- e][1,3]thiazolo[3,2- a]pyrimidin- 5- one
Smiles: O=c1nc2SC(Cn2c2c1CN(CN2)C1CCCCC1)(C)C

STK781013
Synonyms: 1- [2- (3,4- dimethoxyphenyl)ethyl]- 6- propyl- 2- thioxo- 2,3,5,6,7,8- hexahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: CCCN1CNc2c(C1)c(=O)[nH]c(=S)n2CCc1ccc(c(c1)OC)OC

STK685991
Synonyms: (2E)- 2- [(4- {[(1- methyl- 1H- imidazol- 2- yl)sulfanyl]methyl}thiophen- 2- yl)methylidene]hydrazinecarboxamide
Smiles: NC(=O)N/N=C/c1scc(c1)CSc1nccn1C

STK685998
Synonyms: 4- {[2- carboxy- 1- (4- ethoxyphenyl)ethyl]sulfamoyl}benzoicacid
Smiles: CCOc1ccc(cc1)C(NS(=O)(=O)c1ccc(cc1)C(=O)O)CC(=O)O

STK781019
Synonyms: ethyl1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- {[(4- chlorophenyl)sulfonyl]methyl}- 1H- 1,2,3- triazole- 4- carboxylate
Smiles: CCOC(=O)c1nnn(c1CS(=O)(=O)c1ccc(cc1)Cl)c1nonc1N

STK781021
Synonyms: 5- benzyl- 4- hydroxy- 4,5- dimethyl- 3- (phenylamino)- 1,3- oxazolidin- 2- one
Smiles: O=C1OC(C(N1Nc1ccccc1)(C)O)(C)Cc1ccccc1

STK686006
Synonyms: 2- [(3- methylpent- 1- yn- 3- yl)carbamoyl]benzoicacid
Smiles: CCC(NC(=O)c1ccccc1C(=O)O)(C#C)C

STK781023
Synonyms: 8- bromo- 3- nitrodibenzo[b,f]oxepine- 1- carboxamide
Smiles: Brc1ccc2c(c1)C=Cc1c(O2)cc(cc1C(=O)N)[N+](=O)[O-]

STK781025
Synonyms: 5- [(2- hydroxybenzyl)amino]- 1H- pyrazole- 4- carbonitrile
Smiles: N#Cc1cn[nH]c1NCc1ccccc1O

STK781027
Synonyms: 5- [(3,5- dichloro- 2- hydroxybenzyl)amino]- 1H- pyrazole- 4- carbonitrile
Smiles: N#Cc1cn[nH]c1NCc1cc(Cl)cc(c1O)Cl

STK781028
Synonyms: 5- {[2- hydroxy- 3- (prop- 2- en- 1- yl)benzyl]amino}- 1H- pyrazole- 4- carbonitrile
Smiles: C=CCc1cccc(c1O)CNc1[nH]ncc1C#N

STK686008
Synonyms: N- [2- (quinolin- 8- ylsulfanyl)acetyl]benzamide
Smiles: O=C(NC(=O)c1ccccc1)CSc1cccc2c1nccc2

STK781043
Synonyms: 5- (ethylsulfanyl)- 3- methoxy- 1,2- thiazole- 4- carbonitrile
Smiles: CCSc1snc(c1C#N)OC

STK686013
Synonyms: 2- [(3- fluorophenyl)amino]- 5,7- dihydroxythieno[3,2- b]pyridine- 3- carbonitrile
Smiles: N#Cc1c(Nc2cccc(c2)F)sc2c1nc(O)cc2O

STK781044
Synonyms: 4- (2- phenyl- 6,7- dihydro- 5H- cyclopenta[d]pyrimidin- 4- yl)piperazine- 1- carbaldehyde
Smiles: O=CN1CCN(CC1)c1nc(nc2c1CCC2)c1ccccc1

STK781047
Synonyms: 6- {4- [chloro(difluoro)methoxy]phenyl}- 4- (4- hydroxyphenyl)- 1- methyl- 3,4,6,7- tetrahydro- 1H- pyrrolo[3,4- d]pyrimidine- 2,5- dione
Smiles: Oc1ccc(cc1)C1NC(=O)N(C2=C1C(=O)N(C2)c1ccc(cc1)OC(Cl)(F)F)C

STK781048
Synonyms: [4- amino- 2- (phenylamino)- 1,3- thiazol- 5- yl](4- methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)c1sc(nc1N)Nc1ccccc1

STK781049
Synonyms: [4- amino- 2- (prop- 2- en- 1- ylamino)- 1,3- thiazol- 5- yl](4- methoxyphenyl)methanone
Smiles: C=CCNc1nc(c(s1)C(=O)c1ccc(cc1)OC)N

STK781050
Synonyms: [4- amino- 2- (prop- 2- en- 1- ylamino)- 1,3- thiazol- 5- yl](3,4- dimethoxyphenyl)methanone
Smiles: C=CCNc1nc(c(s1)C(=O)c1ccc(c(c1)OC)OC)N

STK781053
Synonyms: 2- (4- iodo- 3,5- dimethyl- 1H- pyrazol- 1- yl)- N- (pyridin- 3- yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)I)C)Nc1cccnc1

STK781060
Synonyms: 2- (4- iodo- 3,5- dimethyl- 1H- pyrazol- 1- yl)- N- (5- methyl- 1,2- oxazol- 3- yl)acetamide
Smiles: Cc1onc(c1)NC(=O)Cn1nc(c(c1C)I)C

STK781068
Synonyms: methyl4,5- dimethyl- 2- {[{[3- (2- methyl- 1H- imidazol- 1- yl)propyl]amino}(oxo)acetyl]amino}thiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC(=O)C(=O)NCCCn2ccnc2C)sc(c1C)C

STK686019
Synonyms: 3- [(4- bromo- 3,5- dimethyl- 1H- pyrazol- 1- yl)methyl]- N- [3- (2- methyl- 1H- imidazol- 1- yl)propyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)Cn1nc(c(c1C)Br)C)NCCCn1ccnc1C

STK781070
Synonyms: N- [3- (2- methyl- 1H- imidazol- 1- yl)propyl]- N'- (quinolin- 5- yl)ethanediamide
Smiles: O=C(C(=O)NCCCn1ccnc1C)Nc1cccc2c1cccn2

STK686020
Synonyms: 6- {[bis(2- hydroxyethyl)amino]methyl}- 1,3- dimethyl[1,3]thiazolo[2,3- f]purine- 2,4(1H,3H)- dione
Smiles: OCCN(Cc1csc2n1c1c(=O)n(C)c(=O)n(c1n2)C)CCO

STK781071
Synonyms: 1,3- dimethyl- 6- ({[3- (trifluoromethyl)phenyl]amino}methyl)[1,3]thiazolo[2,3- f]purine- 2,4(1H,3H)- dione
Smiles: O=c1c2c(nc3n2c(CNc2cccc(c2)C(F)(F)F)cs3)n(c(=O)n1C)C

STK781074
Synonyms: 4- bromo- N- (3- chloro- 2- methylphenyl)- 1- ethyl- 1H- pyrazole- 5- carboxamide
Smiles: CCn1ncc(c1C(=O)Nc1cccc(c1C)Cl)Br

STK686023
Synonyms: 3- [(4- bromo- 3,5- dimethyl- 1H- pyrazol- 1- yl)methyl]- N- (thiophen- 2- ylmethyl)- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)Cn1nc(c(c1C)Br)C)NCc1cccs1

STK781083
Synonyms: 3- [(4- bromo- 3,5- dimethyl- 1H- pyrazol- 1- yl)methyl]- N- [2- (1H- indol- 3- yl)ethyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)Cn1nc(c(c1C)Br)C)NCCc1c[nH]c2c1cccc2

STK781084
Synonyms: 1- [4- (1,3- benzoxazol- 2- yl)piperazin- 1- yl]- 2- (2,3- dihydro- 1H- inden- 1- yl)ethanone
Smiles: O=C(N1CCN(CC1)c1nc2c(o1)cccc2)CC1CCc2c1cccc2

STK781085
Synonyms: N- (2,1,3- benzoxadiazol- 4- yl)furan- 2- carboxamide
Smiles: O=C(c1ccco1)Nc1cccc2c1non2

STK686027
Synonyms: 3,4- dichloro- N- (6,7,8,9- tetrahydro- 5H- [1,2,4]triazolo[4,3- a]azepin- 3- ylmethyl)aniline
Smiles: Clc1cc(ccc1Cl)NCc1nnc2n1CCCCC2

STK781087
Synonyms: 3- chloro- N- (6,7,8,9- tetrahydro- 5H- [1,2,4]triazolo[4,3- a]azepin- 3- ylmethyl)aniline
Smiles: Clc1cccc(c1)NCc1nnc2n1CCCCC2

STK686034
Synonyms: 4,6- dimethyl- 3- [(2E)- 4,4,4- trifluoro- 3- hydroxybut- 2- enoyl]pyridin- 2(1H)- one
Smiles: O=C(c1c(C)cc([nH]c1=O)C)/C=C(\C(F)(F)F)/O

STK781101
Synonyms: 2- ethoxy- N- (6- sulfamoyl- 1,3- benzothiazol- 2- yl)benzamide
Smiles: CCOc1ccccc1C(=O)Nc1nc2c(s1)cc(cc2)S(=O)(=O)N

STK781102
Synonyms: N- [6- (methylsulfamoyl)- 1,3- benzothiazol- 2- yl]pyridine- 4- carboxamide
Smiles: CNS(=O)(=O)c1ccc2c(c1)sc(n2)NC(=O)c1ccncc1

STK781104
Synonyms: ethyl4- (morpholin- 4- yl)- 8- (trifluoromethyl)quinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1N1CCOCC1)cccc2C(F)(F)F

STK781105
Synonyms: methyl4- methoxy- 8- (trifluoromethyl)quinoline- 3- carboxylate
Smiles: COc1c(cnc2c1cccc2C(F)(F)F)C(=O)OC

STK781107
Synonyms: 1- {[4- (2- fluorophenyl)piperazin- 1- yl]carbonyl}- 4,7,7- trimethyl- 2- oxabicyclo[2.2.1]heptan- 3- one
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)N1CCN(CC1)c1ccccc1F

STK781109
Synonyms: N- (4- fluorobenzyl)- 4,7,7- trimethyl- 3- oxo- 2- oxabicyclo[2.2.1]heptane- 1- carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)O1)C)NCc1ccc(cc1)F

STK781115
Synonyms: 4,7,7- trimethyl- 3- oxo- N- [4- (trifluoromethyl)phenyl]bicyclo[2.2.1]heptane- 1- carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1)C)Nc1ccc(cc1)C(F)(F)F

STK781123
Synonyms: N- (3,4- difluorophenyl)- 7,7- dimethyl- 2- oxobicyclo[2.2.1]heptane- 1- carboxamide
Smiles: O=C(C12CCC(C2(C)C)CC1=O)Nc1ccc(c(c1)F)F

STK781127
Synonyms: N- [2- (trifluoromethyl)phenyl]quinoxaline- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)nccn2)Nc1ccccc1C(F)(F)F

STK781128
Synonyms: N- (2,4- difluorophenyl)quinoxaline- 6- carboxamide
Smiles: Fc1ccc(c(c1)F)NC(=O)c1ccc2c(c1)nccn2

STK686036
Synonyms: 2- cyanobenzyl2- aminopyridine- 3- carboxylate
Smiles: N#Cc1ccccc1COC(=O)c1cccnc1N

STK781131
Synonyms: 2- (4- methoxyphenyl)imidazo[1,2- a]pyridin- 3- amine
Smiles: COc1ccc(cc1)c1nc2n(c1N)cccc2

STK686038
Synonyms: 5- (furan- 2- yl)- 3- [4- (trifluoromethyl)phenyl]- 1,2,4- oxadiazole
Smiles: FC(c1ccc(cc1)c1noc(n1)c1ccco1)(F)F

STK781135
Synonyms: 2- {3- [4- (trifluoromethyl)phenyl]- 1,2,4- oxadiazol- 5- yl}pyridine
Smiles: FC(c1ccc(cc1)c1noc(n1)c1ccccn1)(F)F

STK781138
Synonyms: 5- [3- (4- nitro- 1H- pyrazol- 1- yl)propyl]- 3- [4- (trifluoromethyl)phenyl]- 1,2,4- oxadiazole
Smiles: [O-][N+](=O)c1cnn(c1)CCCc1onc(n1)c1ccc(cc1)C(F)(F)F

STK781143
Synonyms: (2E)- 2- [(4- {[(5- amino- 1,3,4- thiadiazol- 2- yl)sulfanyl]methyl}thiophen- 2- yl)methylidene]hydrazinecarboxamide
Smiles: NC(=O)N/N=C/c1scc(c1)CSc1nnc(s1)N

STK781145
Synonyms: 2- {[5,6- bis(4- methoxyphenyl)- 1,2,4- triazin- 3- yl]sulfanyl}- 1- (4- methoxyphenyl)ethanone
Smiles: COc1ccc(cc1)c1nc(SCC(=O)c2ccc(cc2)OC)nnc1c1ccc(cc1)OC

STK686039
Synonyms: N- phenyl- 2- [(8,9,9- trimethyl- 5,6,7,8- tetrahydro- 5,8- methano- 1,2,4- benzotriazin- 3- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccccc1)CSc1nnc2c(n1)C1CCC2(C1(C)C)C

STK686040
Synonyms: 4- chloro- 13,13- dimethyl- 7- oxo- 7,11b,12,13- tetrahydro- 5H- isoindolo[2,1- b][2]benzazepine- 8- carboxylicacid
Smiles: OC(=O)c1cccc2c1C(=O)N1C2CC(C)(C)c2c(C1)c(Cl)ccc2

STK686041
Synonyms: 5,5- dimethyl- 11- oxo- 5,11- dihydroisoindolo[2,1- a]quinoline- 10- carboxylicacid
Smiles: OC(=O)c1cccc2c1C(=O)N1C2=CC(c2c1cccc2)(C)C

STK686042
Synonyms: 2- (4- methoxybenzyl)- 3- (2- methylprop- 2- en- 1- yl)- 1- oxo- 1,2,3,6,7,7a- hexahydro- 3a,6- epoxyisoindole- 7- carboxylicacid
Smiles: COc1ccc(cc1)CN1C(=O)C2C3(C1CC(=C)C)C=CC(C2C(=O)O)O3

STK686043
Synonyms: (2S,6R)- 2,6- di(furan- 2- yl)- 3- (propan- 2- yl)piperidin- 4- one
Smiles: CC(C1C(=O)C[C@@H](N[C@@H]1c1ccco1)c1ccco1)C

STK781147
Synonyms: (2E)- 2- {[4- (1H- benzimidazol- 1- ylmethyl)thiophen- 2- yl]methylidene}hydrazinecarboxamide
Smiles: NC(=O)N/N=C/c1scc(c1)Cn1cnc2c1cccc2

STK781149
Synonyms: methyl6- amino- 4- [4- (1H- benzimidazol- 1- ylmethyl)thiophen- 2- yl]- 5- cyano- 2- methyl- 4H- pyran- 3- carboxylate
Smiles: COC(=O)C1=C(C)OC(=C(C1c1scc(c1)Cn1cnc2c1cccc2)C#N)N

STK686044
Synonyms: 6- amino- 4- [4- (azepan- 1- ylmethyl)thiophen- 2- yl]- 3- methyl- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1scc(c1)CN1CCCCCC1)c(C)[nH]n2

STK686050
Synonyms: 4- {[3- (dimethylamino)propyl]amino}- 5- nitrobenzene- 1,2- dicarbonitrile
Smiles: CN(CCCNc1cc(C#N)c(cc1[N+](=O)[O-])C#N)C

STK781150
Synonyms: 11- oxo- 10- phenyl- 10,11- dihydrodibenzo[b,f][1,4]oxazepine- 7,8- dicarbonitrile
Smiles: N#Cc1cc2c(cc1C#N)Oc1c(C(=O)N2c2ccccc2)cccc1

STK686051
Synonyms: 4- amino- 5- [(4- methoxyphenyl)amino]benzene- 1,2- dicarbonitrile
Smiles: N#Cc1cc(Nc2ccc(cc2)OC)c(cc1C#N)N

STK686052
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 3- [(3- phenylpropanoyl)amino]propanoicacid
Smiles: O=C(NC(c1ccc2c(c1)OCO2)CC(=O)O)CCc1ccccc1

STK686053
Synonyms: 6,7- dimethoxy- 3,3- dimethyl- 1- (3,4,5- trimethoxyphenyl)- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1cc2CC(C)(C)NC(c2cc1OC)c1cc(OC)c(c(c1)OC)OC

STK781154
Synonyms: 3- chloro- N- [2- (trifluoromethyl)- 1H- benzimidazol- 7- yl]benzamide
Smiles: Clc1cccc(c1)C(=O)Nc1cccc2c1[nH]c(n2)C(F)(F)F

STK686055
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 3- [(phenylacetyl)amino]propanoicacid
Smiles: O=C(NC(c1ccc2c(c1)OCO2)CC(=O)O)Cc1ccccc1

STK781157
Synonyms: [4- amino- 2- (phenylamino)- 1,3- thiazol- 5- yl](3,4- dimethoxyphenyl)methanone
Smiles: COc1cc(ccc1OC)C(=O)c1sc(nc1N)Nc1ccccc1

STK781158
Synonyms: {4- amino- 2- [(3- chloro- 4- fluorophenyl)amino]- 1,3- thiazol- 5- yl}(4- methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)c1sc(nc1N)Nc1ccc(c(c1)Cl)F

STK781159
Synonyms: [4- amino- 2- (ethylamino)- 1,3- thiazol- 5- yl](3,4- dimethoxyphenyl)methanone
Smiles: CCNc1nc(c(s1)C(=O)c1ccc(c(c1)OC)OC)N

STK781160
Synonyms: {4- amino- 2- [(4- methoxyphenyl)amino]- 1,3- thiazol- 5- yl}(3,4- dimethoxyphenyl)methanone
Smiles: COc1ccc(cc1)Nc1sc(c(n1)N)C(=O)c1ccc(c(c1)OC)OC

STK781161
Synonyms: (5E)- 2- imino- 5- {[3- (3- nitrophenyl)- 1H- pyrazol- 4- yl]methylidene}- 3- (1,3- thiazol- 2- yl)- 1,3- thiazolidin- 4- one
Smiles: N=C1S/C(=C/c2c[nH]nc2c2cccc(c2)[N+](=O)[O-])/C(=O)N1c1nccs1

STK686057
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 3- [(cyclohexylcarbonyl)amino]propanoicacid
Smiles: OC(=O)CC(c1ccc2c(c1)OCO2)NC(=O)C1CCCCC1

STK686062
Synonyms: 4- {3- [(4- bromo- 2- chlorophenoxy)methyl]- 4- methoxyphenyl}- 3,4- dihydro- 2H,5H- pyrano[3,2- c]chromene- 2,5- dione
Smiles: COc1ccc(cc1COc1ccc(cc1Cl)Br)C1CC(=O)Oc2c1c(=O)oc1c2cccc1

STK686068
Synonyms: 7'- amino- 1- (4- fluorobenzyl)- 2'- [(2- fluorobenzyl)sulfanyl]- 2,4'- dioxo- 1,2,4',8'- tetrahydro- 3'H- spiro[indole- 3,5'- pyrido[2,3- d]pyrimidine]- 6'- carbonitrile
Smiles: N#CC1=C(N)Nc2c(C31c1ccccc1N(C3=O)Cc1ccc(cc1)F)c(=O)[nH]c(n2)SCc1ccccc1F

STK686070
Synonyms: 5- (3- fluorophenyl)- 1,3- dimethyl- 5,8- dihydropyrido[2,3- d]pyrimidine- 2,4,7(1H,3H,6H)- trione
Smiles: O=C1CC(c2cccc(c2)F)c2c(N1)n(C)c(=O)n(c2=O)C

STK781171
Synonyms: 1- [2- chloro- 5- (trifluoromethyl)phenyl]- 5- oxo- 2- (1H- pyrrol- 1- yl)- 4- (thiophen- 2- yl)- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccs1)C(=O)CCC2)c1cc(ccc1Cl)C(F)(F)F

STK686072
Synonyms: (3Z)- 3- (3,3- dimethyl- 3,4- dihydroisoquinolin- 1(2H)- ylidene)- 2- oxo- N- (1,3- thiazol- 2- yl)propanamide
Smiles: O=C(C(=O)/C=C/1\NC(C)(C)Cc2c1cccc2)Nc1nccs1

STK686074
Synonyms: N- (1- phenyl- 1H- pyrazol- 3- yl)furan- 2- carboxamide
Smiles: O=C(c1ccco1)Nc1ccn(n1)c1ccccc1

STK686075
Synonyms: N- [6- tert- butyl- 3- (methylsulfanyl)- 5- oxo- 1,2,4- triazin- 4(5H)- yl]- 2- chlorobenzamide
Smiles: CSc1nnc(c(=O)n1NC(=O)c1ccccc1Cl)C(C)(C)C

STK781182
Synonyms: 3- methyl- 6- phenyl- 1,2,4- triazin- 5(4H)- one
Smiles: Cc1nnc(c(=O)[nH]1)c1ccccc1

STK686077
Synonyms: 3- (4- methoxyphenyl)- 7- [(4- methylphenyl)amino]- 4H- [1,3,4]thiadiazolo[2,3- c][1,2,4]triazin- 4- one
Smiles: COc1ccc(cc1)c1nnc2n(c1=O)nc(s2)Nc1ccc(cc1)C

STK781184
Synonyms: 4- amino- 3- [(4- chlorophenyl)amino]- 1,2,4- triazin- 5(4H)- one
Smiles: Clc1ccc(cc1)Nc1nncc(=O)n1N

STK781190
Synonyms: 1- (3- chloro- 4- fluorophenyl)- 4- (3- fluorophenyl)- 5- oxo- 2- (1H- pyrrol- 1- yl)- 1,4,5,6,7,8- hexahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(n2cccc2)N(C2=C(C1c1cccc(c1)F)C(=O)CCC2)c1ccc(c(c1)Cl)F

STK686079
Synonyms: 7- methyl- 4- (3,4,5- trimethoxyphenyl)- 3,4- dihydro- 2H- dipyrido[1,2- a:3',2'- e]pyrimidine- 2,5(1H)- dione
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)Nc2c1c(=O)nc1n2cccc1C

STK686080
Synonyms: 7- methyl- 4- (thiophen- 2- yl)- 3,4- dihydro- 2H- dipyrido[1,2- a:3',2'- e]pyrimidine- 2,5(1H)- dione
Smiles: O=C1CC(c2cccs2)c2c(N1)n1cccc(c1nc2=O)C

STK781193
Synonyms: 4- phenyl- 3,4- dihydro- 2H- pyrido[3,2- e][1,3]thiazolo[3,2- a]pyrimidine- 2,5(1H)- dione
Smiles: O=C1CC(c2ccccc2)c2c(N1)n1ccsc1nc2=O

STK781194
Synonyms: 4- [4- (trifluoromethyl)phenyl]- 3,4- dihydro- 2H- pyrido[3,2- e][1,3]thiazolo[3,2- a]pyrimidine- 2,5(1H)- dione
Smiles: O=C1CC(c2ccc(cc2)C(F)(F)F)c2c(N1)n1ccsc1nc2=O

STK686082
Synonyms: 7'- amino- 2'- [(2- chlorobenzyl)sulfanyl]- 2,4'- dioxo- 1- (prop- 2- yn- 1- yl)- 1,2,4',8'- tetrahydro- 3'H- spiro[indole- 3,5'- pyrido[2,3- d]pyrimidine]- 6'- carbonitrile
Smiles: C#CCN1c2ccccc2C2(C1=O)C(=C(N)Nc1c2c(=O)[nH]c(n1)SCc1ccccc1Cl)C#N

STK781195
Synonyms: 4- (3- fluorophenyl)- 4,6- dihydro- 2H- pyrano[3,2- c]quinoline- 2,5(3H)- dione
Smiles: O=C1CC(c2cccc(c2)F)c2c(O1)c1ccccc1[nH]c2=O

STK686085
Synonyms: 7- amino- 4- oxo- 5- [2- (propan- 2- yloxy)phenyl]- 1,5- dihydro- 4H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1OC(C)C)c(=O)nc[nH]2

STK781197
Synonyms: ethyl6- chloro- 2,3,4,9- tetrahydro- 1H- carbazole- 7- carboxylate
Smiles: CCOC(=O)c1cc2[nH]c3c(c2cc1Cl)CCCC3

STK686087
Synonyms: 6- hydroxy- 4- methyl- 2- oxo- 1- propyl- 5- (pyrrolidin- 1- ylmethyl)- 1,2- dihydropyridine- 3- carbonitrile
Smiles: CCCn1c(O)c(CN2CCCC2)c(c(c1=O)C#N)C

STK781199
Synonyms: 3- amino- 7- methyl[1,2,4]triazolo[4,3- a]pyrimidin- 5- ol
Smiles: Cc1cc(O)n2c(n1)nnc2N

STK686088
Synonyms: 2- (4- iodo- 1H- pyrazol- 1- yl)- N- (pyridin- 3- yl)acetamide
Smiles: O=C(Cn1ncc(c1)I)Nc1cccnc1

STK686090
Synonyms: 2- (4- iodo- 1H- pyrazol- 1- yl)- N- (pyridin- 2- yl)acetamide
Smiles: O=C(Nc1ccccn1)Cn1ncc(c1)I

STK781207
Synonyms: 4- {[(4- iodo- 1H- pyrazol- 1- yl)acetyl]amino}benzamide
Smiles: O=C(Cn1ncc(c1)I)Nc1ccc(cc1)C(=O)N

STK686095
Synonyms: N- [4- (acetylamino)phenyl]- 2- (4- iodo- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1ncc(c1)I)Nc1ccc(cc1)NC(=O)C

STK781210
Synonyms: N- cycloheptyl- 2- (4- iodo- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1ncc(c1)I)NC1CCCCCC1

STK686098
Synonyms: 2- (4- iodo- 1H- pyrazol- 1- yl)- N- (propan- 2- yl)acetamide
Smiles: CC(NC(=O)Cn1ncc(c1)I)C

STK686099
Synonyms: N- [2- (1H- indol- 3- yl)ethyl]- 2- (4- iodo- 1H- pyrazol- 1- yl)acetamide
Smiles: O=C(Cn1ncc(c1)I)NCCc1c[nH]c2c1cccc2

STK781213
Synonyms: 3- chloro- N- [1- (propan- 2- yl)- 1H- pyrazol- 4- yl]benzamide
Smiles: Clc1cccc(c1)C(=O)Nc1cnn(c1)C(C)C

STK781214
Synonyms: 3,4- dimethoxy- N- [1- (propan- 2- yl)- 1H- pyrazol- 4- yl]benzamide
Smiles: COc1cc(ccc1OC)C(=O)Nc1cnn(c1)C(C)C

STK781215
Synonyms: 2,6- difluoro- N- [1- (propan- 2- yl)- 1H- pyrazol- 4- yl]benzamide
Smiles: O=C(c1c(F)cccc1F)Nc1cnn(c1)C(C)C

STK781216
Synonyms: methyl4- {[1- (propan- 2- yl)- 1H- pyrazol- 4- yl]carbamoyl}benzoate
Smiles: COC(=O)c1ccc(cc1)C(=O)Nc1cnn(c1)C(C)C

STK781218
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 3- [4- (trifluoromethyl)phenyl]- 1,2,4- oxadiazole- 5- carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)C(F)(F)F)NCc1ccc2c(c1)OCO2

STK781221
Synonyms: N- (2,1,3- benzoxadiazol- 4- yl)- 4- bromobenzamide
Smiles: Brc1ccc(cc1)C(=O)Nc1cccc2c1non2

STK781222
Synonyms: N- (2,1,3- benzoxadiazol- 4- yl)- 2,4- dichlorobenzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)Nc1cccc2c1non2

STK781223
Synonyms: N- (2,1,3- benzoxadiazol- 4- yl)- 2- phenylacetamide
Smiles: O=C(Nc1cccc2c1non2)Cc1ccccc1

STK781225
Synonyms: 4- bromo- 1- ethyl- N- [4- (trifluoromethyl)phenyl]- 1H- pyrazole- 5- carboxamide
Smiles: CCn1ncc(c1C(=O)Nc1ccc(cc1)C(F)(F)F)Br

STK686102
Synonyms: 2- oxo- 2- phenylethyl2- (1,3- benzothiazol- 2- yl)benzoate
Smiles: O=C(c1ccccc1c1nc2c(s1)cccc2)OCC(=O)c1ccccc1

STK781230
Synonyms: 2- (3- chlorophenyl)- 1H- pyrrolo[3,4- c]pyridine- 1,3(2H)- dione
Smiles: Clc1cccc(c1)N1C(=O)c2c(C1=O)cncc2

STK686105
Synonyms: 2- {[2- (naphthalen- 2- yloxy)ethyl]sulfanyl}quinoline
Smiles: C(Oc1ccc2c(c1)cccc2)CSc1ccc2c(n1)cccc2

STK686106
Synonyms: 2- {[2- (naphthalen- 2- yloxy)ethyl]sulfanyl}- 1,3- benzoxazole
Smiles: C(Oc1ccc2c(c1)cccc2)CSc1nc2c(o1)cccc2

STK686107
Synonyms: 9- benzyl- N- phenyl- 9H- [1,2,4]triazolo[4,3- a]benzimidazol- 3- amine
Smiles: c1ccc(cc1)Nc1nnc2n1c1ccccc1n2Cc1ccccc1

STK781231
Synonyms: 1- ethyl- N- {2- [(1- methyl- 1H- benzimidazol- 2- yl)sulfanyl]ethyl}- 1H- benzimidazol- 2- amine
Smiles: CCn1c(NCCSc2nc3c(n2C)cccc3)nc2c1cccc2

STK781233
Synonyms: {4- amino- 2- [(2- fluorophenyl)amino]- 1,3- thiazol- 5- yl}(4- chlorophenyl)methanone
Smiles: Clc1ccc(cc1)C(=O)c1sc(nc1N)Nc1ccccc1F

STK781234
Synonyms: [4- amino- 2- (benzylamino)- 1,3- thiazol- 5- yl](4- methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)c1sc(nc1N)NCc1ccccc1

STK781235
Synonyms: {4- amino- 2- [(4- methoxyphenyl)amino]- 1,3- thiazol- 5- yl}(4- fluorophenyl)methanone
Smiles: COc1ccc(cc1)Nc1nc(c(s1)C(=O)c1ccc(cc1)F)N

STK781237
Synonyms: 5,5- bis(3- fluorobenzyl)- 1,3- dimethylpyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Fc1cccc(c1)CC1(Cc2cccc(c2)F)C(=O)N(C)C(=O)N(C1=O)C

STK781239
Synonyms: 2,2'- (1,3- dimethyl- 2,4,6- trioxohexahydropyrimidine- 5,5- diyl)bis(N,N- diethylacetamide)
Smiles: CCN(C(=O)CC1(CC(=O)N(CC)CC)C(=O)N(C)C(=O)N(C1=O)C)CC

STK781244
Synonyms: ethyl4- [(4- oxo- 4H- pyrido[3,2- e][1,3]thiazin- 2- yl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc(=O)c2c(s1)nccc2

STK686116
Synonyms: N'- {[(4- hydroxy- 6- phenylpyrimidin- 2- yl)sulfanyl]acetyl}- 2- methylbenzohydrazide
Smiles: O=C(NNC(=O)c1ccccc1C)CSc1nc(O)cc(n1)c1ccccc1

STK686128
Synonyms: 4- [2,4- bis(morpholin- 4- ylsulfonyl)phenoxy]- N- phenylbenzamide
Smiles: O=C(c1ccc(cc1)Oc1ccc(cc1S(=O)(=O)N1CCOCC1)S(=O)(=O)N1CCOCC1)Nc1ccccc1

STK686131
Synonyms: [1- (2,6- dichlorobenzyl)- 1H- benzimidazol- 2- yl](phenyl)methanol
Smiles: Clc1cccc(c1Cn1c(nc2c1cccc2)C(c1ccccc1)O)Cl

STK781256
Synonyms: 1- (dimethylamino)- 4- (4- ethoxyphenyl)- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: CCOc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CCC2)N(C)C

STK686135
Synonyms: 1- (dimethylamino)- 7- phenyl- 4- [2- (trifluoromethyl)phenyl]- 4,6,7,8- tetrahydroquinoline- 2,5(1H,3H)- dione
Smiles: CN(N1C(=O)CC(C2=C1CC(CC2=O)c1ccccc1)c1ccccc1C(F)(F)F)C

STK781257
Synonyms: 4- (naphthalen- 2- yl)- 3,4- dihydro- 2H,5H- pyrano[3,2- c]chromene- 2,5- dione
Smiles: O=C1CC(c2ccc3c(c2)cccc3)c2c(O1)c1ccccc1oc2=O

STK686136
Synonyms: 4,5- bis(2,5- dimethylthiophen- 3- yl)- 1,3- dioxol- 2- one
Smiles: Cc1sc(cc1c1oc(=O)oc1c1cc(sc1C)C)C

STK686138
Synonyms: 6- (4- fluorophenyl)- 6,9- dihydropyrido[3,2- e][1,2,4]triazolo[1,5- a]pyrimidine- 5,8(4H,7H)- dione
Smiles: O=C1CC(c2ccc(cc2)F)c2c(N1)n1ncnc1[nH]c2=O

STK686139
Synonyms: 4- (3,4- dimethoxyphenyl)- 7- methyl- 3,4- dihydro- 2H- dipyrido[1,2- a:3',2'- e]pyrimidine- 2,5(1H)- dione
Smiles: COc1cc(ccc1OC)C1CC(=O)Nc2c1c(=O)nc1n2cccc1C

STK686142
Synonyms: 4- (3- methoxyphenyl)- 4,6- dihydro- 2H- pyrano[3,2- c]quinoline- 2,5(3H)- dione
Smiles: COc1cccc(c1)C1CC(=O)Oc2c1c(=O)[nH]c1c2cccc1

STK781264
Synonyms: 7- amino- 4- oxo- 5- [3- (trifluoromethyl)phenyl]- 1,5- dihydro- 4H- pyrano[2,3- d]pyrimidine- 6- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1)C(F)(F)F)c(=O)nc[nH]2

STK686143
Synonyms: 4- amino- 5- [(4- methoxyphenyl)carbonyl]- 2- (methylamino)thiophene- 3- carbonitrile
Smiles: CNc1sc(c(c1C#N)N)C(=O)c1ccc(cc1)OC

STK781266
Synonyms: ethyl{[4- (4,6- dimethyl- 2- oxo- 1,2- dihydropyridin- 3- yl)- 1,1,1- trifluoro- 4- oxobutan- 2- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSC(C(F)(F)F)CC(=O)c1c(C)cc([nH]c1=O)C

STK686146
Synonyms: 4,6- dimethyl- 3- [1- methyl- 5- (trifluoromethyl)- 4,5- dihydro- 1H- pyrazol- 3- yl]pyridin- 2(1H)- one
Smiles: CN1N=C(CC1C(F)(F)F)c1c(C)cc([nH]c1=O)C

STK781267
Synonyms: 4,6- dimethyl- 3- [4,4,4- trifluoro- 3- (piperidin- 1- yl)butanoyl]pyridin- 2(1H)- one
Smiles: O=C(c1c(C)cc([nH]c1=O)C)CC(C(F)(F)F)N1CCCCC1

STK781269
Synonyms: 4,6- dimethyl- 3- [3- (trifluoromethyl)- 1,2- oxazol- 5- yl]pyridin- 2(1H)- one
Smiles: Cc1cc(C)[nH]c(=O)c1c1onc(c1)C(F)(F)F

STK686147
Synonyms: 3- [5- hydroxy- 5- (trifluoromethyl)- 4,5- dihydro- 1H- pyrazol- 3- yl]- 4,6- dimethylpyridin- 2(1H)- one
Smiles: FC(C1(O)NN=C(C1)c1c(C)cc([nH]c1=O)C)(F)F

STK781271
Synonyms: 3- (ethylsulfanyl)- 5,7- dimethylpyrimido[4,5- e][1,2,4]triazine- 6,8(5H,7H)- dione
Smiles: CCSc1nnc2c(n1)n(C)c(=O)n(c2=O)C

STK686148
Synonyms: pyrimido[4,5- e][1,2,4]triazine- 3,6,8(2H,5H,7H)- trione
Smiles: O=c1[nH]nc2c(n1)[nH]c(=O)[nH]c2=O

STK686149
Synonyms: 5,7- dimethylpyrimido[4,5- e][1,2,4]triazine- 3,6,8(2H,5H,7H)- trione
Smiles: O=c1[nH]nc2c(n1)n(C)c(=O)n(c2=O)C

STK686150
Synonyms: 5,7- dimethyl- 3- thioxo- 3,5- dihydropyrimido[4,5- e][1,2,4]triazine- 6,8(2H,7H)- dione
Smiles: S=c1[nH]nc2c(n1)n(C)c(=O)n(c2=O)C

STK781272
Synonyms: ethyl5- amino- 3- oxo- 1- (phenylcarbonyl)- 2,3- dihydro- 1H- pyrazole- 4- carboxylate
Smiles: CCOC(=O)c1c(=O)[nH]n(c1N)C(=O)c1ccccc1

STK686151
Synonyms: [4- (4- hydroxy- 4,4- diphenylbut- 2- yn- 1- yl)piperazin- 1- yl](phenyl)methanone
Smiles: O=C(c1ccccc1)N1CCN(CC1)CC#CC(c1ccccc1)(c1ccccc1)O