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

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STK541339
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- {(E)- [5- (4- fluorophenyl)- 1H- pyrazol- 4- yl]methylidene}acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1cn[nH]c1c1ccc(cc1)F

STK541340
Synonyms: 2- {[5- (3- bromophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1E)- 1- phenylbutylidene]acetohydrazide
Smiles: CCC/C(=N\NC(=O)CSc1nnc(n1C)c1cccc(c1)Br)/c1ccccc1

STK541341
Synonyms: 8- (3- methylphenyl)- 9- (prop- 2- en- 1- ylsulfanyl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: C=CCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCc1c3cccc1

STK541342
Synonyms: 4- benzyl- 1- (methylsulfanyl)- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CC(OC3)C(C)C

STK541343
Synonyms: 7- chloro- 4- (morpholin- 4- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: Clc1ncnc2c1sc1c2c2CCCc2c(n1)N1CCOCC1

STK541344
Synonyms: 2- {[2- (3- methoxyphenyl)- 2- oxoethyl]sulfanyl}- 6- methyl- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydro- 1,6- naphthyridine- 3- carbonitrile
Smiles: N#Cc1c(SCC(=O)c2cccc(c2)OC)nc2c(c1c1cccs1)CN(CC2)C

STK541346
Synonyms: ethyl2- amino- 4- {2- [(2- chlorobenzyl)oxy]phenyl}- 7,7- dimethyl- 5- oxo- 5,6,7,8- tetrahydro- 4H- chromene- 3- carboxylate
Smiles: CCOC(=O)C1=C(N)OC2=C(C1c1ccccc1OCc1ccccc1Cl)C(=O)CC(C2)(C)C

STK541347
Synonyms: (8R,8aS,11aR,11bR)- 10- (3- fluorophenyl)- 8- (phenylcarbonyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Fc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H]1N([C@H]2C(=O)c2ccccc2)C=Cc2c1cccc2

STK541348
Synonyms: (8S,8aR,11aS,11bS)- 8- acetyl- 10- (4- fluorophenyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: CC(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1C=Cc1c2cccc1)c1ccc(cc1)F

STK541351
Synonyms: 2- {3- [2- (3,4- dimethoxyphenyl)ethyl]- 1- (4- methoxyphenyl)- 5- oxo- 2- thioxoimidazolidin- 4- yl}- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)N1C(=O)C(N(C1=S)CCc1ccc(c(c1)OC)OC)CC(=O)Nc1ccc(cc1)OC

STK541352
Synonyms: N'- [(1E)- 1- (naphthalen- 2- yl)ethylidene]- 2- (pyridin- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(N/N=C(/c1ccc2c(c1)cccc2)\C)CSc1ccccn1

STK541353
Synonyms: 7- [3- (4- chlorophenoxy)- 2- hydroxypropyl]- 1,3- dimethyl- 8- (4- methylpiperazin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CN1CCN(CC1)c1nc2c(n1CC(COc1ccc(cc1)Cl)O)c(=O)n(c(=O)n2C)C

STK541354
Synonyms: 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N'- [(E)- (3- phenoxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1cccc(c1)Oc1ccccc1

STK541355
Synonyms: (8R,8aS,11aR,11bR)- 8- [(4- bromophenyl)carbonyl]- 10- phenyl- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1N2C=Cc3c([C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1)cccc3

STK541356
Synonyms: 6- [3- acetyl- 2- (4- fluorophenyl)- 4- hydroxy- 5- oxo- 2,5- dihydro- 1H- pyrrol- 1- yl]hexanoicacid
Smiles: OC(=O)CCCCCN1C(c2ccc(cc2)F)C(=C(C1=O)O)C(=O)C

STK541357
Synonyms: 2- {3- [2- (3,4- dimethoxyphenyl)ethyl]- 1- [4- (dimethylamino)phenyl]- 5- oxo- 2- thioxoimidazolidin- 4- yl}- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CC1N(CCc2ccc(c(c2)OC)OC)C(=S)N(C1=O)c1ccc(cc1)N(C)C

STK541358
Synonyms: methyl5- bromo- 3- {[(3- methylphenyl)carbonyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1cccc(c1)C)cc(cc2)Br

STK541359
Synonyms: methyl2- {[(pyridin- 4- ylcarbonyl)carbamothioyl]amino}- 4,5,6,7,8,9,10,11,12,13- decahydrocyclododeca[b]thiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC(=S)NC(=O)c2ccncc2)sc2c1CCCCCCCCCC2

STK541360
Synonyms: 3- amino- N- [4- chloro- 3- (trifluoromethyl)phenyl]- 6- (3,4- dimethoxyphenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1cc(ccc1OC)c1ccc2c(n1)sc(c2N)C(=O)Nc1ccc(c(c1)C(F)(F)F)Cl

STK541361
Synonyms: 2- (ethylsulfanyl)- 6,6- dimethyl- 3- (3- methylphenyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)(C)C

STK541362
Synonyms: 2- [(2- chloro- 6- fluorobenzyl)sulfanyl]- 6- methyl- 4- (thiophen- 2- yl)- 5,6,7,8- tetrahydro- 1,6- naphthyridine- 3- carbonitrile
Smiles: N#Cc1c(SCc2c(F)cccc2Cl)nc2c(c1c1cccs1)CN(CC2)C

STK541363
Synonyms: 2- {[3- (4- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc3c2cccc3)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK541367
Synonyms: ethyl5- chloro- 3- {[(2- methoxyphenyl)carbamoyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)Nc1ccccc1OC)cc(cc2)Cl

STK541369
Synonyms: methyl{[7,7- dimethyl- 5- oxo- 4- (2- phenylethyl)- 4,5,6,9- tetrahydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CC(OC3)(C)C

STK541370
Synonyms: 8- bromo- 4- (3,5- dimethylpiperidin- 1- yl)- 5H- pyrimido[5,4- b]indole
Smiles: CC1CC(C)CN(C1)c1ncnc2c1[nH]c1c2cc(cc1)Br

STK541371
Synonyms: 1- [5- (4- methoxyphenyl)- 3- (thiophen- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 2- (piperidin- 1- yl)ethanone
Smiles: COc1ccc(cc1)C1CC(=NN1C(=O)CN1CCCCC1)c1cccs1

STK541372
Synonyms: (3aR,6aS)- 5- (2- chlorophenyl)- 3- (4- nitrophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: O=C1[C@H]2[C@@H](C(=O)N1c1ccccc1Cl)ON=C2c1ccc(cc1)[N+](=O)[O-]

STK541375
Synonyms: (1'R,2'S,3R)- 2'- (furan- 2- ylcarbonyl)- 2- oxo- N- phenyl- 1,1',2,2'- tetrahydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinoline]- 1'- carboxamide
Smiles: O=C([C@@H]1N2c3ccccc3C=CC2[C@]2([C@@H]1C(=O)c1ccco1)C(=O)Nc1c2cccc1)Nc1ccccc1

STK541377
Synonyms: ethyl4- (3- benzyl- 2,5- dioxopyrrolidin- 1- yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)Cc1ccccc1

STK541378
Synonyms: ethyl3- {4- cyano- 1- [4- (9H- fluoren- 9- yl)piperazin- 1- yl]- 3- methylpyrido[1,2- a]benzimidazol- 2- yl}propanoate
Smiles: CCOC(=O)CCc1c(C)c(C#N)c2n(c1N1CCN(CC1)C1c3ccccc3c3c1cccc3)c1ccccc1n2

STK541380
Synonyms: 2- [(3,4- dichlorobenzyl)sulfanyl]- 3,6,6- trimethyl- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Clc1ccc(cc1Cl)CSc1nc2sc3c(c2c(=O)n1C)CC(OC3)(C)C

STK541381
Synonyms: N- [1- (1- phenylethyl)- 3- (phenylsulfonyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl]propanamide
Smiles: CCC(=O)Nc1n(C(c2ccccc2)C)c2c(c1S(=O)(=O)c1ccccc1)nc1c(n2)cccc1

STK541383
Synonyms: 2- [(E)- 2- (4- fluorophenyl)ethenyl]- 6- iodo- 3- (3- nitrophenyl)quinazolin- 4(3H)- one
Smiles: Fc1ccc(cc1)/C=C/c1nc2ccc(cc2c(=O)n1c1cccc(c1)[N+](=O)[O-])I

STK541384
Synonyms: 9'- bromo- 2'- (2,4- dimethoxyphenyl)- 4- phenyl- 1',10b'- dihydrospiro[cyclohexane- 1,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: COc1cc(OC)ccc1C1=NN2C(C1)c1cc(Br)ccc1OC12CCC(CC1)c1ccccc1

STK541385
Synonyms: 2- ethyl- 5- oxo- 5- (1,3- thiazol- 2- ylamino)pentanoicacid
Smiles: CCC(C(=O)O)CCC(=O)Nc1nccs1

STK541386
Synonyms: 6- chloro- 3- [5- (4- methoxyphenyl)- 1- (methylsulfonyl)- 4,5- dihydro- 1H- pyrazol- 3- yl]- 2- methyl- 4- phenylquinoline
Smiles: COc1ccc(cc1)C1CC(=NN1S(=O)(=O)C)c1c(C)nc2c(c1c1ccccc1)cc(cc2)Cl

STK541387
Synonyms: ethyl1- (4- bromophenyl)- 5,6,7,8- tetrafluoro- 4- (pentafluorophenyl)- 1,4- dihydro- 1,2,4- benzodiazaphosphinine- 3- carboxylate4- oxide
Smiles: CCOC(=O)C1=NN(c2ccc(cc2)Br)c2c(P1(=O)c1c(F)c(F)c(c(c1F)F)F)c(F)c(c(c2F)F)F

STK541388
Synonyms: (3aS,6aS)- 5- (3,5- dichlorophenyl)- 3- (4- nitrophenyl)- 1- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: Clc1cc(Cl)cc(c1)N1C(=O)[C@H]2[C@@H](C1=O)N(N=C2c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK541389
Synonyms: (4E)- 4- [hydroxy(4- methoxyphenyl)methylidene]- 5- (3- phenoxyphenyl)- 1- [2- (piperazin- 1- yl)ethyl]pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Oc1ccccc1)CCN1CCNCC1)/O

STK541393
Synonyms: (2Z)- 2- [5- (4- bromobenzyl)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]- 2- cyano- N- (3- methylphenyl)ethanamide
Smiles: N#C/C(=C\1/SC(C(=O)N1c1ccccc1)Cc1ccc(cc1)Br)/C(=O)Nc1cccc(c1)C

STK541394
Synonyms: methyl5- chloro- 3- {[2- (3- methylpiperidin- 1- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C(N1CCCC(C1)C)C)cc(cc2)Cl

STK541397
Synonyms: 2- (hexylsulfanyl)- 6,6- dimethyl- 3- (4- methylphenyl)- 3,5,6,8- tetrahydro- 4H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CCCCCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(SC3)(C)C

STK541398
Synonyms: (8R,8aR)- 6- amino- 8- (2,5- dimethoxyphenyl)- 2- propyl- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: CCCN1CC=C2[C@H](C1)[C@@H](c1cc(OC)ccc1OC)C(C(=C2C#N)N)(C#N)C#N

STK541400
Synonyms: methyl3- {[(4- fluorophenyl)carbamothioyl]amino}- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=S)Nc1ccc(cc1)F)cc(cc2)C

STK541402
Synonyms: N- phenyl- 2- [(10- phenyl- 8,9- dihydro- 7H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccccc1)CSc1nnc2n1cnc1c2sc2c1c1CCCc1c(n2)c1ccccc1

STK541404
Synonyms: N- {2- [(3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}- 3- phenylpropanamide
Smiles: N#Cc1c(sc2c1CCCC2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)CCc1ccccc1

STK541407
Synonyms: 11- (4- bromophenyl)- 3- pentyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)Br

STK541408
Synonyms: 2- [4- (4- chlorobenzyl)piperazin- 1- yl]- N'- [(E)- (4- nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)Cl)N/N=C/c1ccc(cc1)[N+](=O)[O-]

STK541410
Synonyms: 2,2,2- trifluoro- 1- {1- hydroxy- 3,3- dimethyl- 11- [4- (pentyloxy)phenyl]- 2,3,4,11- tetrahydro- 10H- dibenzo[b,e][1,4]diazepin- 10- yl}ethanone
Smiles: CCCCCOc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C(F)(F)F)cccc2)(C)C

STK541411
Synonyms: S- {[5- oxo- 4- (2- phenylethyl)- 4,5,6,7,8,9- hexahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]methyl}methyl(phenyl)carbamothioate
Smiles: CN(c1ccccc1)C(=O)SCc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CCCC3

STK541412
Synonyms: pentyl{[5- oxo- 4- (2- phenylethyl)- 4,5,6,7,8,9- hexahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}acetate
Smiles: CCCCCOC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CCCC3

STK541414
Synonyms: 3- cyclohexyl- 2- [(4- methoxybenzyl)sulfanyl]- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: COc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CC(OC3)C(C)C

STK541415
Synonyms: N~4~- benzyl- N~2~- (4- bromophenyl)quinazoline- 2,4- diamine
Smiles: Brc1ccc(cc1)Nc1nc(NCc2ccccc2)c2c(n1)cccc2

STK541416
Synonyms: (2E)- 3- (4- methoxyphenyl)- N- {[4- (2- methoxyphenyl)piperazin- 1- yl]carbonothioyl}prop- 2- enamide
Smiles: COc1ccc(cc1)/C=C/C(=O)NC(=S)N1CCN(CC1)c1ccccc1OC

STK541417
Synonyms: N- (3- nitrophenyl)- 2- [(3,4,8- trimethyl- 2- oxo- 2H- chromen- 7- yl)oxy]acetamide
Smiles: O=C(Nc1cccc(c1)[N+](=O)[O-])COc1ccc2c(c1C)oc(=O)c(c2C)C

STK541418
Synonyms: diphenylmethyl(1'R,2'S,3R)- 2- oxo- 2'- (phenylcarbonyl)- 1,1',2,2'- tetrahydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinoline]- 1'- carboxylate
Smiles: O=C([C@@H]1N2c3ccccc3C=CC2[C@]2([C@@H]1C(=O)c1ccccc1)C(=O)Nc1c2cccc1)OC(c1ccccc1)c1ccccc1

STK541419
Synonyms: 4- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl)- 6,7- dimethoxy- 2- phenylquinazoline
Smiles: COc1cc2c(cc1OC)nc(nc2N1CCC2(CC1)OCCO2)c1ccccc1

STK541420
Synonyms: (3aR,6aS)- 5- (4- acetylphenyl)- 3- (4- bromophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: Brc1ccc(cc1)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)C(=O)C

STK541421
Synonyms: N- ({4- [(5- ethyl- 1,3,4- thiadiazol- 2- yl)sulfamoyl]phenyl}carbamothioyl)- 4- fluorobenzamide
Smiles: CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)c1ccc(cc1)F

STK541422
Synonyms: N- (3- chlorophenyl)- 10- methyl- 8- phenyl- 11- (3,4,5- trimethoxyphenyl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1cc(cc(c1OC)OC)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cccc(c1)Cl)nc1c2cccc1

STK541423
Synonyms: (4E)- 5- (2- fluorophenyl)- 4- [hydroxy(4- methoxyphenyl)methylidene]- 1- (pyridin- 3- ylmethyl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)Cc1cccnc1)/O

STK541424
Synonyms: 1- hydroxy- 3- methyl- 2- octylpyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1O)c1ccccc1n2

STK541425
Synonyms: 2- (4- benzylpiperazin- 1- yl)- N'- [(E)- (5- bromo- 2- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccc(cc1/C=N/NC(=O)CN1CCN(CC1)Cc1ccccc1)Br

STK541426
Synonyms: methanediylbis[diphenyl(phosphinodithioate)]
Smiles: S=P(c1ccccc1)(c1ccccc1)SCSP(=S)(c1ccccc1)c1ccccc1

STK541427
Synonyms: 2- ({[(4- bromophenyl)carbonyl]carbamothioyl}amino)- 6- ethyl- 4,5,6,7- tetrahydrothieno[2,3- c]pyridine- 3- carboxamide
Smiles: CCN1CCc2c(C1)sc(c2C(=O)N)NC(=S)NC(=O)c1ccc(cc1)Br

STK541428
Synonyms: N- (4- bromophenyl)- N'- (4- methoxybenzyl)hydrazine- 1,2- dicarbothioamide
Smiles: COc1ccc(cc1)CNC(=S)NNC(=S)Nc1ccc(cc1)Br

STK541429
Synonyms: 2- [4- (benzyloxy)- 3- methoxyphenyl]- 5- (2,5- dimethylphenyl)- 4- phenyl- 1H- imidazole
Smiles: COc1cc(ccc1OCc1ccccc1)c1[nH]c(c(n1)c1ccccc1)c1cc(C)ccc1C

STK541430
Synonyms: (2E)- 2- cyano- 3- [3- methoxy- 4- (propan- 2- yloxy)phenyl]- N- (pyridin- 3- yl)prop- 2- enamide
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OC(C)C)/C(=O)Nc1cccnc1

STK541431
Synonyms: (4E)- 4- [hydroxy(4- methoxyphenyl)methylidene]- 5- (4- methoxyphenyl)- 1- (pyrimidin- 2- yl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)OC)N(C(=O)C1=O)c1ncccn1)/O

STK541432
Synonyms: 2- [4- (2- chlorobenzyl)piperazin- 1- yl]- N'- [(1Z)- 1- (thiophen- 2- yl)ethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccccc1Cl)N/N=C(\c1cccs1)/C

STK541433
Synonyms: 8- fluoro- 3- {[(E)- (3- fluorophenyl)methylidene]amino}- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Fc1cccc(c1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cc(cc1)F

STK541434
Synonyms: 2- amino- 1- (4- chlorophenyl)- N- (3- methyl- 1- phenyl- 1H- pyrazol- 5- yl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Clc1ccc(cc1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)Nc1cc(nn1c1ccccc1)C

STK541435
Synonyms: 2- (2- fluorophenyl)- 5,7- dipropyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: CCCC12CN3CC(C2=O)(CN(C1)C3c1ccccc1F)CCC

STK541436
Synonyms: (4E)- 5- [4- (dimethylamino)phenyl]- 4- (1- hydroxyethylidene)- 1- (pyridin- 3- ylmethyl)pyrrolidine- 2,3- dione
Smiles: CN(c1ccc(cc1)C1/C(=C(\O)/C)/C(=O)C(=O)N1Cc1cccnc1)C

STK541437
Synonyms: methyl7- (3- chloro- 4- methylphenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: COC(=O)C1=NNC2(C1)CC(=O)N(C2=O)c1ccc(c(c1)Cl)C

STK541438
Synonyms: 3- [(Z)- {3- [2- (3,4- dimethoxyphenyl)ethyl]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene}methyl]- 9- methyl- 2- [(2- methylpropyl)amino]- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: COc1cc(CCN2C(=S)S/C(=C\c3c(NCC(C)C)nc4n(c3=O)cccc4C)/C2=O)ccc1OC

STK541439
Synonyms: N- (2,5- dimethylphenyl)- 11- (2- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1ccc(c(c1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccccc1F)C)c1ccccc1)C

STK541440
Synonyms: 2- (butylsulfanyl)- 8,8- dimethyl- 3- (4- methylphenyl)- 3,6,8,9- tetrahydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 4- one
Smiles: CCCCSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1ccc(cc1)C

STK541441
Synonyms: 4- {[(E)- (4- hydroxy- 3,5- diiodophenyl)methylidene]amino}- 1,5- dimethyl- 2- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: Oc1c(I)cc(cc1I)/C=N/c1c(C)n(n(c1=O)c1ccccc1)C

STK541442
Synonyms: 3- amino- 6- (thiophen- 2- yl)- N- [2- (trifluoromethyl)phenyl]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)ccc(n2)c1cccs1)Nc1ccccc1C(F)(F)F

STK541444
Synonyms: 3- {(Z)- [3- (4- fluorobenzyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (thiomorpholin- 4- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: Fc1ccc(cc1)CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCSCC2)/C1=O

STK541445
Synonyms: ethyl(8S,8aR)- 6- amino- 5,7,7- tricyano- 8- (3,4- diethoxyphenyl)- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1ccc(c(c1)OCC)OCC)C(C(=C2C#N)N)(C#N)C#N

STK541446
Synonyms: N- [1- (1H- benzimidazol- 2- yl)- 3- (methylsulfanyl)propyl]- 4- fluorobenzamide
Smiles: CSCCC(c1nc2c([nH]1)cccc2)NC(=O)c1ccc(cc1)F

STK541447
Synonyms: 2- [4- (4- chlorobenzyl)piperazin- 1- yl]- N'- {(E)- [4- (dimethylamino)phenyl]methylidene}acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)Cl)N/N=C/c1ccc(cc1)N(C)C

STK541449
Synonyms: methyl(1R,2R,3R,3aS)- 2- (4- bromophenyl)- 3- cyano- 1- (phenylcarbonyl)- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinoline- 3- carboxylate
Smiles: COC(=O)[C@]1(C#N)[C@@H](c2ccc(cc2)Br)[C@@H](N2[C@H]1C=Cc1c2cccc1)C(=O)c1ccccc1

STK541450
Synonyms: 4- (4- chlorophenyl)- N,1- diphenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carbothioamide
Smiles: Clc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=S)Nc1ccccc1)c1ccccc1

STK541452
Synonyms: 2- [(E)- 2- (2,4- dichlorophenyl)ethenyl]- 3- (naphthalen- 2- yl)quinazolin- 4(3H)- one
Smiles: Clc1ccc(c(c1)Cl)/C=C/c1nc2ccccc2c(=O)n1c1ccc2c(c1)cccc2

STK541456
Synonyms: N- {3- [(4- methylphenyl)sulfonyl]- 1- octyl- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}benzenesulfonamide
Smiles: CCCCCCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccccc1)S(=O)(=O)c1ccc(cc1)C

STK541457
Synonyms: 11- (3,4- dimethoxyphenyl)- 10- methyl- 8- phenyl- N- [3- (trifluoromethyl)phenyl]- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(cc1OC)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cccc(c1)C(F)(F)F)c1ccccc1

STK541458
Synonyms: 4- chloro- N- [2- (dimethylamino)- 1,2- dihydroacenaphthylen- 1- yl]benzenesulfonamide
Smiles: CN(C1C(NS(=O)(=O)c2ccc(cc2)Cl)c2c3c1cccc3ccc2)C

STK541459
Synonyms: 2- (2- aminophenyl)- N- (2,6- dichlorophenyl)acetamide
Smiles: O=C(Nc1c(Cl)cccc1Cl)Cc1ccccc1N

STK541460
Synonyms: 8- chloro- 3- (2,2- dimethoxyethyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COC(Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)Cl)OC

STK541461
Synonyms: ethyl(2Z)- 2- {[5- (4- bromophenyl)furan- 2- yl]methylidene}- 7- methyl- 5- (4- methylphenyl)- 3- oxo- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)/c(=C/c1ccc(o1)c1ccc(cc1)Br)/s2

STK541462
Synonyms: N- [5- (hydrazinylcarbonyl)- 4- methyl- 1,3- thiazol- 2- yl]- 4- methylbenzenesulfonamide
Smiles: NNC(=O)c1sc(nc1C)NS(=O)(=O)c1ccc(cc1)C

STK541463
Synonyms: 2- (5- amino- 2H- tetrazol- 2- yl)- N'- [(E)- (2- hydroxy- 5- nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1cc(ccc1O)[N+](=O)[O-]

STK541464
Synonyms: N- (3- methoxyphenyl)- 2- {[4- oxo- 3- (prop- 2- en- 1- yl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2)OC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK541465
Synonyms: 2- amino- N- (2- methoxybenzyl)- 1- (3- methoxypropyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCc1ccccc1OC

STK541466
Synonyms: 2- {4- [(4- bromophenyl)sulfonyl]piperazin- 1- yl}- N'- [(Z)- (2- nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C\c1ccccc1[N+](=O)[O-]

STK541467
Synonyms: 2- [(3- benzyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N- (furan- 2- ylmethyl)acetamide
Smiles: O=C(CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3)NCc1ccco1

STK541468
Synonyms: 4- chloro- N- [2- (phenylcarbonyl)phenyl]benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Nc1ccccc1C(=O)c1ccccc1

STK541469
Synonyms: (3aS,6aS)- 3- (4- bromophenyl)- 5- (3,5- dichlorophenyl)- 1- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: Brc1ccc(cc1)C1=NN([C@H]2[C@@H]1C(=O)N(C2=O)c1cc(Cl)cc(c1)Cl)c1ccccc1

STK541470
Synonyms: 2- amino- 1- (2,5- dimethoxyphenyl)- N- (4- fluorobenzyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccc(cc1n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCc1ccc(cc1)F)OC

STK541471
Synonyms: 7- (4- {[(3,4- difluorophenyl)carbonyl]carbamothioyl}piperazin- 1- yl)- 1- ethyl- 6- fluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=S)NC(=O)c1ccc(c(c1)F)F)c(c2)F

STK541474
Synonyms: 2- [(3Z)- 3- (1- hydroxyethylidene)- 2- (4- nitrophenyl)- 4,5- dioxopyrrolidin- 1- yl]propanoicacid
Smiles: OC(=O)C(N1C(=O)C(=O)/C(=C(\O)/C)/C1c1ccc(cc1)[N+](=O)[O-])C

STK541476
Synonyms: 5,10- diphenyl- 2,7- bis[3- (trifluoromethyl)phenyl]tetrahydropyrrolo[3,4- c]pyrrolo[3',4':4,5]pyrazolo[1,2- a]pyrazole- 1,3,6,8(2H,3aH,5H,7H)- tetrone
Smiles: O=C1N(c2cccc(c2)C(F)(F)F)C(=O)C2C1N1C(c3ccccc3)C3C(N1C2c1ccccc1)C(=O)N(C3=O)c1cccc(c1)C(F)(F)F

STK541478
Synonyms: N'- [2,2- dimethyl- 5- (pyrrolidin- 1- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- yl]- N,N- dimethylpropane- 1,3- diamine
Smiles: CN(CCCNc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCCC1)C

STK541479
Synonyms: N'- {(E)- [4- (benzyloxy)phenyl]methylidene}- 2- [4- (4- chlorobenzyl)piperazin- 1- yl]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)Cl)N/N=C/c1ccc(cc1)OCc1ccccc1

STK541481
Synonyms: N'- [(E)- (2,5- dimethoxyphenyl)methylidene]- 2- [4- (4- methylbenzyl)piperazin- 1- yl]acetohydrazide
Smiles: COc1ccc(cc1/C=N/NC(=O)CN1CCN(CC1)Cc1ccc(cc1)C)OC

STK541482
Synonyms: 6- iodo- 3- (prop- 2- en- 1- yl)- 2- (propylsulfanyl)quinazolin- 4(3H)- one
Smiles: C=CCn1c(SCCC)nc2c(c1=O)cc(cc2)I

STK541483
Synonyms: 7- benzyl- 1,3- dimethyl- 8- [(naphthalen- 2- ylmethyl)sulfanyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=c1n(C)c2nc(n(c2c(=O)n1C)Cc1ccccc1)SCc1ccc2c(c1)cccc2

STK541484
Synonyms: ethyl3- [(benzylcarbamothioyl)amino]- 5- chloro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=S)NCc1ccccc1)cc(cc2)Cl

STK541486
Synonyms: 2- [4- (4- methylbenzyl)piperazin- 1- yl]- N'- [(E)- (2- methylphenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)C)N/N=C/c1ccccc1C

STK541488
Synonyms: 11- (3- bromophenyl)- N- (4- chlorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Brc1cccc(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1)Cl)c1ccccc1

STK541489
Synonyms: 5- [5- (2- chlorophenyl)- 3- (3,4- dimethoxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 5- oxopentanoicacid
Smiles: COc1ccc(cc1OC)C1=NN(C(C1)c1ccccc1Cl)C(=O)CCCC(=O)O

STK541490
Synonyms: 1- methyl- 7- (phenylamino)- 8H- naphtho[2,3- a]phenoxazine- 8,13(14H)- dione
Smiles: O=c1c2c3[nH]c4c(C)cccc4oc3cc(c2c(=O)c2c1cccc2)Nc1ccccc1

STK541491
Synonyms: 2- {4- [(4- bromophenyl)sulfonyl]piperazin- 1- yl}- N'- [(1Z)- 1- phenylethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C(\c1ccccc1)/C

STK541492
Synonyms: (6aS,6bR,9aS,10R)- 10- (1H- benzotriazol- 1- ylcarbonyl)- 8- (2,4- dichlorophenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Clc1ccc(c(c1)Cl)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)n1nnc2c1cccc2

STK541493
Synonyms: 4- nitro- N- {3- [(3,4,5- trimethoxyphenyl)amino]quinoxalin- 2- yl}benzenesulfonamide
Smiles: COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccc(cc2)[N+](=O)[O-])cc(c1OC)OC

STK541494
Synonyms: (3aR,6aS)- 5- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 3- (4- nitrophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: O=C1[C@H]2ON=C([C@H]2C(=O)N1c1ccc2c(c1)OCCO2)c1ccc(cc1)[N+](=O)[O-]

STK541495
Synonyms: 11- (4- chlorophenyl)- N- (3,5- dichlorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Clc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cc(Cl)cc(c1)Cl)c1ccccc1

STK541496
Synonyms: 2- cyano- N- pentyl- 2- [3- (piperidin- 1- yl)quinoxalin- 2- yl]acetamide
Smiles: CCCCCNC(=O)C(c1nc2ccccc2nc1N1CCCCC1)C#N

STK541497
Synonyms: 2- amino- 1- (2- methoxybenzyl)- N- (tetrahydrofuran- 2- ylmethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccccc1Cn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCC1CCCO1

STK541500
Synonyms: 3- [(Z)- (3- ethyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 2- (thiomorpholin- 4- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCSCC2)/C1=O

STK541501
Synonyms: 8- benzyl- 9- [(3- methylbutyl)sulfanyl]- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CC(CCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCc1c3cccc1)C

STK541502
Synonyms: 1- (benzyloxy)- 3- (3- nitrophenyl)quinoxalin- 2(1H)- one4- oxide
Smiles: [O-][N+](=O)c1cccc(c1)c1c(=O)n(OCc2ccccc2)c2c([n+]1[O-])cccc2

STK541503
Synonyms: N- {2- [(Z)- 2- (4- tert- butylphenyl)- 1- cyanoethenyl]- 4- phenyl- 1,3- thiazol- 5- yl}propanamide
Smiles: N#C/C(=C/c1ccc(cc1)C(C)(C)C)/c1sc(c(n1)c1ccccc1)NC(=O)CC

STK541504
Synonyms: 3- (2- chlorophenyl)- 2- (2- nitrophenyl)quinazolin- 4(3H)- one
Smiles: [O-][N+](=O)c1ccccc1c1nc2ccccc2c(=O)n1c1ccccc1Cl

STK541505
Synonyms: 2- {[(2Z)- 3- chlorobut- 2- en- 1- yl]sulfanyl}- 3- phenylquinazolin- 4(3H)- one
Smiles: C/C(=C/CSc1nc2ccccc2c(=O)n1c1ccccc1)/Cl

STK541506
Synonyms: (9E)- 9- (3- methoxybenzylidene)- 5- (3- methoxyphenyl)- 3- (4- methylphenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: COc1cccc(c1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)C)/C(=C/c1cccc(c1)OC)/CCC2

STK541509
Synonyms: 2- {[(2E)- 3- chlorobut- 2- en- 1- yl]sulfanyl}- 6,6- dimethyl- 3- (4- methylphenyl)- 3,5,6,8- tetrahydro- 4H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: C/C(=C\CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(SC3)(C)C)/Cl

STK541510
Synonyms: 4- (2- {[(2- chlorophenyl)carbamothioyl]amino}ethyl)benzenesulfonamide
Smiles: S=C(Nc1ccccc1Cl)NCCc1ccc(cc1)S(=O)(=O)N

STK541513
Synonyms: 2- [(E)- 2- (2,4- dichlorophenyl)ethenyl]quinazolin- 4(3H)- one
Smiles: Clc1ccc(c(c1)Cl)/C=C/c1nc2ccccc2c(=O)[nH]1

STK541514
Synonyms: 2- {[2- (4- fluorophenyl)- 2- oxoethyl]sulfanyl}- 6,6- dimethyl- 3- (prop- 2- en- 1- yl)- 3,5,6,8- tetrahydro- 4H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: C=CCn1c(SCC(=O)c2ccc(cc2)F)nc2c(c1=O)c1CC(C)(C)SCc1s2

STK541515
Synonyms: N- (4- {[3- (pyrrolidin- 1- yl)quinoxalin- 2- yl]sulfamoyl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1N1CCCC1

STK541516
Synonyms: 3- (3- methylphenyl)- 2- (pentylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCC3

STK541517
Synonyms: N~6~- benzyl- N~4~- (furan- 2- ylmethyl)- 7- nitro- 2,1,3- benzoxadiazole- 4,6- diamine
Smiles: [O-][N+](=O)c1c(NCc2ccccc2)cc(c2c1non2)NCc1ccco1

STK541518
Synonyms: 3- benzyl- 5- ethyl- 5- methyl- 2- (pentylsulfanyl)- 5,6- dihydrobenzo[h]quinazolin- 4(3H)- one
Smiles: CCCCCSc1nc2c3ccccc3CC(c2c(=O)n1Cc1ccccc1)(C)CC

STK541519
Synonyms: N- {3- [(4- methylphenyl)sulfonyl]- 1- (prop- 2- en- 1- yl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}naphthalene- 2- sulfonamide
Smiles: C=CCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc2c(c1)cccc2)S(=O)(=O)c1ccc(cc1)C

STK541520
Synonyms: 5- (5- chloro- 2- methoxyphenyl)- 4- (2,5- dimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(c(c1)n1c(=S)[nH]nc1c1cc(Cl)ccc1OC)OC

STK541521
Synonyms: 2- {[3- (3,4- dichlorophenyl)- 5,6- dimethyl- 4- oxo- 3,4- dihydrothieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc2sc(c(c2c(=O)n1c1ccc(c(c1)Cl)Cl)C)C

STK541523
Synonyms: 3- (prop- 2- en- 1- yl)- 2- thioxo- 1,2,3,5- tetrahydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: C=CCn1c(=S)[nH]c2c(c1=O)[nH]c1c2cccc1

STK541525
Synonyms: 11- (4- chlorophenyl)- N- (2- methoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccccc1Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)Cl)c(nn1c1ccccc1)C

STK541526
Synonyms: N- (1,2- dihydroacenaphthylen- 5- yl)- 2- [4- (6- nitro- 1,3- benzothiazol- 2- yl)piperazin- 1- yl]acetamide
Smiles: O=C(Nc1ccc2c3c1cccc3CC2)CN1CCN(CC1)c1sc2c(n1)ccc(c2)[N+](=O)[O-]

STK541527
Synonyms: (4E)- N- hydroxy- 1,3- dimethyl- 2,6- diphenylpiperidin- 4- imine
Smiles: O/N=C/1\CC(c2ccccc2)N(C(C1C)c1ccccc1)C

STK541528
Synonyms: N'- [(E)- (5- bromo- 2- fluorophenyl)methylidene]- 2- ({5- [(4- methylbenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccc(cc1)C)N/N=C/c1cc(Br)ccc1F

STK541529
Synonyms: 2- (4- benzylpiperazin- 1- yl)- N'- [(E)- (3,4,5- trimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CN2CCN(CC2)Cc2ccccc2)cc(c1OC)OC

STK541530
Synonyms: 2- {[6,6- dimethyl- 3- (4- methylphenyl)- 4- oxo- 3,5,6,8- tetrahydro- 4H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- (furan- 2- ylmethyl)acetamide
Smiles: O=C(NCc1ccco1)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(SC3)(C)C

STK541531
Synonyms: 1- [(2E)- 2- (3- cyclohexylpropylidene)hydrazinyl]methanediamine
Smiles: NC(N/N=C/CCC1CCCCC1)N

STK541533
Synonyms: 8- chloro- 2- methyl- 3- {[(E)- (4- nitrophenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Clc1ccc2c(c1)c1nc(C)n(c(=O)c1[nH]2)/N=C/c1ccc(cc1)[N+](=O)[O-]

STK541534
Synonyms: 11- tert- butyl- 3,7- bis[(4- methoxybenzyl)sulfanyl]- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:4',3'- c]pyrimidine
Smiles: COc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c1n2c(SCc2ccc(cc2)OC)nn1)CCC(C3)C(C)(C)C

STK541535
Synonyms: 2- {4- [(4- bromophenyl)sulfonyl]piperazin- 1- yl}- N'- {(E)- [2- (trifluoromethyl)phenyl]methylidene}acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C/c1ccccc1C(F)(F)F

STK541536
Synonyms: (4E)- 1- [3- (dimethylamino)propyl]- 4- [hydroxy(4- methoxyphenyl)methylidene]- 5- (4- methoxyphenyl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)OC)CCCN(C)C)/O

STK541537
Synonyms: (6aR,6bS,9aR,10S)- 10- [(4- bromophenyl)carbonyl]- 2- chloro- 8- phenyl- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Clc1ccc2c(c1)N1[C@H](C=C2)[C@@H]2[C@H]([C@H]1C(=O)c1ccc(cc1)Br)C(=O)N(C2=O)c1ccccc1

STK541539
Synonyms: 2- [(6- amino- 1,3- benzothiazol- 2- yl)sulfanyl]- N- (2- {[2- (1,2,3,4,5,6,7,8- octahydro- 9H- carbazol- 9- yl)- 2- oxoethyl]sulfanyl}- 1,3- benzothiazol- 6- yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)n1c2CCCCc2c2c1CCCC2)CSc1nc2c(s1)cc(cc2)N

STK541540
Synonyms: methyl2- (butanoylamino)- 4- methyl- 5- phenylthiophene- 3- carboxylate
Smiles: CCCC(=O)Nc1sc(c(c1C(=O)OC)C)c1ccccc1

STK541541
Synonyms: 11- [2- (cyclohex- 1- en- 1- yl)ethyl]- 3- (prop- 2- en- 1- yl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: C=CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2CCC1=CCCCC1

STK541542
Synonyms: 2- (4- chloro- 3- fluorophenyl)- 9- (4- methylphenyl)tetrahydro- 5H- pyrazolo[1,2- a]pyrrolo[3,4- c]pyrazole- 1,3(2H,3aH)- dione
Smiles: Cc1ccc(cc1)C1N2CCCN2C2C1C(=O)N(C2=O)c1ccc(c(c1)F)Cl

STK541543
Synonyms: 11- (4- tert- butylphenyl)- 10- methyl- N- (4- methylphenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)C(C)(C)C)C)c1ccccc1

STK541544
Synonyms: ethyl[3- cyano- 5- (propan- 2- yl)- 4,7- dihydro- 5H- thieno[2,3- c]pyran- 2- yl]imidoformate
Smiles: CCO/C=N/c1sc2c(c1C#N)CC(OC2)C(C)C

STK541545
Synonyms: 2- (methylsulfanyl)- 6,8- diphenyl- 5,8- dihydro- 6H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CSc1nc(N)c2c(n1)sc1c2CC(SC1c1ccccc1)c1ccccc1

STK541546
Synonyms: N- (2,4- dichlorophenyl)- 2- [(4- phenyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK541547
Synonyms: N- (3- chlorophenyl)- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indole- 2- carboxamide
Smiles: Clc1cccc(c1)NC(=O)N1CCc2c(C1)c1ccccc1[nH]2

STK541548
Synonyms: (3aS,6aS)- 5- (4- acetylphenyl)- 3- (4- nitrophenyl)- 1- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: CC(=O)c1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C(=NN2c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

STK541550
Synonyms: 11- benzyl- 3- butyl- 2- methyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccccc1

STK541551
Synonyms: N- {2- [(4,5- dimethyl- 1,3- benzothiazol- 2- yl)amino]- 1,1,1,3,3,3- hexafluoropropan- 2- yl}- 2- methoxybenzamide
Smiles: COc1ccccc1C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1sc2c(n1)c(C)c(cc2)C

STK541552
Synonyms: 7- {4- [(2- chlorophenyl)carbamothioyl]piperazin- 1- yl}- 1- ethyl- 6- fluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=S)Nc1ccccc1Cl)c(c2)F

STK541553
Synonyms: 4- chloro- N- (2- {4- [(4- methylphenyl)carbonyl]piperazin- 1- yl}- 1,2- dihydroacenaphthylen- 1- yl)benzenesulfonamide
Smiles: Cc1ccc(cc1)C(=O)N1CCN(CC1)C1c2cccc3c2c(C1NS(=O)(=O)c1ccc(cc1)Cl)ccc3

STK541554
Synonyms: 4- (benzyloxy)- N'- [(E)- pyridin- 4- ylmethylidene]benzohydrazide
Smiles: O=C(c1ccc(cc1)OCc1ccccc1)N/N=C/c1ccncc1

STK541555
Synonyms: 8- ethyl- 8- methyl- 3- (4- methylphenyl)- 2- (propylsulfanyl)- 3,6,8,9- tetrahydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 4- one
Smiles: CCCSc1nc2nc3CC(C)(CC)OCc3cc2c(=O)n1c1ccc(cc1)C

STK541556
Synonyms: 1- (4- chlorophenyl)- 2- {[5- (furan- 2- yl)- 2,2- dimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- yl]sulfanyl}ethanone
Smiles: Clc1ccc(cc1)C(=O)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccco1

STK541557
Synonyms: 8,8- dimethyl- 3- (3- methylphenyl)- 2- (propylsulfanyl)- 3,6,8,9- tetrahydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 4- one
Smiles: CCCSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1cccc(c1)C

STK541558
Synonyms: 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3

STK541559
Synonyms: 5- (2- methylpropyl)- 8- {[4- (propan- 2- yloxy)benzyl]sulfanyl}- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: CC(Cc1nc2sc3c(c2c2c1CCCC2)ncnc3SCc1ccc(cc1)OC(C)C)C

STK541560
Synonyms: 2- {4- [(4- bromophenyl)sulfonyl]piperazin- 1- yl}- N'- [(E)- (2- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br

STK541562
Synonyms: 4- phenyl- 2'- [4- (phenylsulfanyl)phenyl]- 1',10b'- dihydrospiro[cyclohexane- 1,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: c1ccc(cc1)Sc1ccc(cc1)C1=NN2C(C1)c1ccccc1OC12CCC(CC1)c1ccccc1

STK541563
Synonyms: 2- methyl- 11- (4- methylphenyl)- 3- (2- phenylethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Cc1ccc(cc1)n1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)CCc1ccccc1

STK541565
Synonyms: 11- (4- chlorophenyl)- N- (4- ethylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)Cl)c(nn1c1ccccc1)C

STK541566
Synonyms: N,N- dibutyl- 2- [(5- propyl- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl)sulfanyl]acetamide
Smiles: CCCCN(C(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)CCC)CCCC

STK541567
Synonyms: 1- (4- chlorophenyl)- 2- (furan- 2- yl)- 1H- imidazo[4,5- b]quinoxaline
Smiles: Clc1ccc(cc1)n1c(nc2c1nc1ccccc1n2)c1ccco1

STK541568
Synonyms: (2E)- 1- [3- (4- bromophenyl)- 5- (2,3- dimethoxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 3- phenylprop- 2- en- 1- one
Smiles: COc1c(OC)cccc1C1CC(=NN1C(=O)/C=C/c1ccccc1)c1ccc(cc1)Br

STK541569
Synonyms: ethyl5- methoxy- 3- [(propan- 2- ylcarbamoyl)amino]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)NC(C)C)cc(cc2)OC

STK541570
Synonyms: 3- amino- 2- [(4- bromophenyl)carbonyl]- 7,7- dimethyl- 7,8- dihydrothieno[2,3- b]quinolin- 5(6H)- one
Smiles: Brc1ccc(cc1)C(=O)c1sc2c(c1N)cc1c(n2)CC(CC1=O)(C)C

STK541573
Synonyms: 1- [4- (2- hydroxyethyl)piperazin- 1- yl]- 3- methyl- 2- (3- methylbutyl)pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: OCCN1CCN(CC1)c1c(CCC(C)C)c(C)c(c2n1c1ccccc1n2)C#N

STK541575
Synonyms: methyl4- {6- [(4- butylphenyl)amino]- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl}benzoate
Smiles: CCCCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(=O)OC)c(nn1c1ccccc1)C

STK541576
Synonyms: N'- [(E)- (4- bromophenyl)methylidene]- 2- [4- (4- methylbenzyl)piperazin- 1- yl]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)C)N/N=C/c1ccc(cc1)Br

STK541577
Synonyms: 2- [4- (4- chlorobenzyl)piperazin- 1- yl]- N'- [(E)- (3,4- dimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CN2CCN(CC2)Cc2ccc(cc2)Cl)ccc1OC

STK541579
Synonyms: N- (2- methylphenyl)- 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3

STK541580
Synonyms: N- [4- (acetylamino)phenyl]- 2- {[3- (4- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)NC(=O)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK541581
Synonyms: (4E)- 4- [hydroxy(4- methoxy- 3- methylphenyl)methylidene]- 1- (3- methoxypropyl)- 5- phenylpyrrolidine- 2,3- dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/O)/C1c1ccccc1

STK541582
Synonyms: (4E)- 5- (2- chlorophenyl)- 4- (1- hydroxyethylidene)- 1- (2- methoxyethyl)pyrrolidine- 2,3- dione
Smiles: COCCN1C(=O)C(=O)/C(=C(/O)\C)/C1c1ccccc1Cl

STK541583
Synonyms: methyl(1S,2S,3S)- 1- acetyl- 3- cyano- 7- methoxy- 2- (4- nitrophenyl)- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinoline- 3- carboxylate
Smiles: COc1ccc2c(c1)C=CC1N2[C@H](C(=O)C)[C@H]([C@]1(C#N)C(=O)OC)c1ccc(cc1)[N+](=O)[O-]

STK541584
Synonyms: 4- phenyl- N- (4- phenylbutan- 2- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- amine
Smiles: CC(Nc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1)CCc1ccccc1

STK541585
Synonyms: N- (3,4- dimethylphenyl)- 10- methyl- 8,11- diphenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1nn(c2c1C(c1ccccc1)n1c(=N2)c(Nc2ccc(c(c2)C)C)nc2c1cccc2)c1ccccc1

STK541586
Synonyms: ethyl3- [(benzylcarbamothioyl)amino]- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=S)NCc1ccccc1)cc(cc2)F

STK541588
Synonyms: ethylN- (5,6- dimethyl- 1,3- benzothiazol- 2- yl)- 3,3,3- trifluoro- 2- (pentanoylamino)alaninate
Smiles: CCCCC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1sc2c(n1)cc(c(c2)C)C

STK541589
Synonyms: N- [1,1,1,3,3,3- hexafluoro- 2- ({5- [(4- nitrophenyl)sulfonyl]- 1,3- thiazol- 2- yl}amino)propan- 2- yl]furan- 2- carboxamide
Smiles: O=C(c1ccco1)NC(C(F)(F)F)(C(F)(F)F)Nc1ncc(s1)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

STK541590
Synonyms: ethyl7- (3- bromophenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: CCOC(=O)C1=NNC2(C1)CC(=O)N(C2=O)c1cccc(c1)Br

STK541591
Synonyms: 3- benzyl- 6- iodo- 2- [(E)- 2- (4- nitrophenyl)ethenyl]quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(cc1)[N+](=O)[O-])Cc1ccccc1

STK541592
Synonyms: N- [4- (acetylamino)phenyl]- 2- {[3- (2- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccccc1n1c(SCC(=O)Nc2ccc(cc2)NC(=O)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK541594
Synonyms: 2- [4- (4- chlorobenzyl)piperazin- 1- yl]- N'- [(E)- thiophen- 2- ylmethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)Cl)N/N=C/c1cccs1

STK541595
Synonyms: 2- (2,6- dimethylmorpholin- 4- yl)- 3- {(Z)- [3- (2- methoxyethyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 7- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: COCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CC(C)OC(C2)C)/C1=O

STK541596
Synonyms: 9- benzyl- 2- (4- methoxybenzyl)- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccc(cc1)Cc1nn2c(n1)c1c(nc2)sc2c1CCN(C2)Cc1ccccc1

STK541597
Synonyms: 9- [(4- bromobenzyl)sulfanyl]- 8- ethyl- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: CCn1c(SCc2ccc(cc2)Br)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK541599
Synonyms: (8S,8aR,11aS)- N- (4- chlorophenyl)- 10- (2,4- dichlorophenyl)- 9,11- dioxo- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 8- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1Cl)Cl)cccc3

STK541600
Synonyms: (8R,8aR)- 6- amino- 2- benzyl- 8- (2- methoxynaphthalen- 1- yl)- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)Cc1ccccc1)c1c(OC)ccc2c1cccc2)(C#N)C#N

STK541601
Synonyms: 2- [(2- benzyl- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]- N- (diphenylmethyl)acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nc(Cc2ccccc2)nc2c1c1CC(C)(C)OCc1s2

STK541602
Synonyms: 1- (4- methylphenyl)- N,4- diphenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: Cc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1)cc3c1ccccc1

STK541603
Synonyms: 2- [(3- ethyl- 4- oxo- 3,4,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N,N- dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2sc3c(c2c(=O)n1CC)CCCC3)CCC

STK541604
Synonyms: 1,1'- (9- hydroxy- 1,5- dimethyl- 3,7- diazabicyclo[3.3.1]nonane- 3,7- diyl)dipropan- 1- one
Smiles: CCC(=O)N1CC2(C)CN(CC(C1)(C2O)C)C(=O)CC

STK541606
Synonyms: (3Z)- 5,5- dimethyl- 3- {[4- (5- methyl- 1,3- benzothiazol- 2- yl)phenyl]imino}cyclohex- 1- en- 1- ol
Smiles: OC1=C/C(=N\c2ccc(cc2)c2nc3c(s2)ccc(c3)C)/CC(C1)(C)C

STK541607
Synonyms: 9- methyl- 3- [(Z)- (4- oxo- 3- propyl- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 2- (thiomorpholin- 4- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCSCC2)/C1=O

STK541608
Synonyms: 4- (4- chlorophenyl)- 1- (4- methylphenyl)- N- (prop- 2- en- 1- yl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carbothioamide
Smiles: C=CCNC(=S)c1c(c2ccc(cc2)C)c2c3n1cc(n3CCCC2)c1ccc(cc1)Cl

STK541610
Synonyms: 2- cyano- N- (4- ethoxyphenyl)- 2- [3- (morpholin- 4- yl)quinoxalin- 2- yl]acetamide
Smiles: CCOc1ccc(cc1)NC(=O)C(c1nc2ccccc2nc1N1CCOCC1)C#N

STK541611
Synonyms: N- (2,4- dimethylphenyl)- 2- [(3- ethyl- 4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]acetamide
Smiles: CCc1c(=O)oc2c(c1C)ccc(c2)OCC(=O)Nc1ccc(cc1C)C

STK541612
Synonyms: N~6~- benzyl- N~4~,N~4~- diethyl- 7- nitro- 2,1,3- benzoxadiazole- 4,6- diamine
Smiles: CCN(c1cc(NCc2ccccc2)c(c2c1non2)[N+](=O)[O-])CC

STK541613
Synonyms: (4E)- 4- [hydroxy(thiophen- 2- yl)methylidene]- 1- (5- methyl- 1,3,4- thiadiazol- 2- yl)- 5- (3- phenoxyphenyl)pyrrolidine- 2,3- dione
Smiles: Cc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2cccs2)/O)/C1c1cccc(c1)Oc1ccccc1

STK541614
Synonyms: 2'- (3,4- dichlorophenyl)- 1- (propan- 2- yl)- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CC(N1CCC2(CC1)Oc1ccccc1C1N2N=C(C1)c1ccc(c(c1)Cl)Cl)C

STK541615
Synonyms: 2- amino- 1- (1,3- benzodioxol- 5- yl)- N- (4- fluorobenzyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Fc1ccc(cc1)CNC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccc2c(c1)OCO2

STK541616
Synonyms: 2- methyl- 10,11- dihydro- 9H- spiro[benzo[h][1,3]thiazino[2,3- b]quinazoline- 6,1'- cyclohexan]- 7(5H)- one
Smiles: Cc1ccc2c(c1)c1nc3SCCCn3c(=O)c1C1(C2)CCCCC1

STK541617
Synonyms: 3- {[(E)- (4- butoxyphenyl)methylidene]amino}- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCCCOc1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1

STK541618
Synonyms: diethyl6- methyl- 2- (3- nitrophenyl)- 4- [(3- nitrophenyl)amino]cyclohexa- 3,5- diene- 1,3- dicarboxylate
Smiles: CCOC(=O)C1C(=CC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OCC)Nc1cccc(c1)[N+](=O)[O-])C

STK541619
Synonyms: 2- amino- N- (4- ethoxyphenyl)- 1- (4- hydroxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCOc1ccc(cc1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)O

STK541620
Synonyms: N- (4- chlorophenyl)- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indole- 2- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)N1CCc2c(C1)c1ccccc1[nH]2

STK541621
Synonyms: N- [3- (methylsulfanyl)- 1- (1- pentyl- 1H- benzimidazol- 2- yl)propyl]benzamide
Smiles: CCCCCn1c(nc2c1cccc2)C(NC(=O)c1ccccc1)CCSC

STK541622
Synonyms: (4Z)- 1- butyl- 4- (1- hydroxyethylidene)- 5- (4- methoxyphenyl)pyrrolidine- 2,3- dione
Smiles: CCCCN1C(=O)C(=O)/C(=C(\O)/C)/C1c1ccc(cc1)OC

STK541623
Synonyms: 11- (4- chlorophenyl)- N- (2,5- dimethylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Clc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cc(C)ccc1C)nc1c2cccc1

STK541625
Synonyms: 7- benzyl- 2- (ethylsulfanyl)- 3- (3- methylphenyl)- 5,6,7,8- tetrahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: CCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCN(C3)Cc1ccccc1

STK541626
Synonyms: 11- (4- bromophenyl)- 3- butyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)Br

STK541628
Synonyms: 2- amino- 1- (9- ethyl- 9H- carbazol- 3- yl)- N- (2- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCn1c2ccc(cc2c2c1cccc2)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCc1ccccc1

STK541629
Synonyms: phenyl(6aR,6bS,9aR,10S)- 7,9- dioxo- 8- [3- (trifluoromethyl)phenyl]- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxylate
Smiles: O=C([C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1cccc(c1)C(F)(F)F)C=Cc1c2cccc1)Oc1ccccc1

STK541630
Synonyms: 6- [(2Z)- 2- (3,4- dihydronaphthalen- 1(2H)- ylidene)hydrazinyl][1,2,4]triazolo[4,3- b]pyridazine
Smiles: c1ccc2c(c1)/C(=N\Nc1ccc3n(n1)cnn3)/CCC2

STK541631
Synonyms: 4- phenyl- N,N- dipropyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- amine
Smiles: CCCN(c1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1)CCC

STK541632
Synonyms: ethyl6- amino- 5,7,7- tricyano- 8- [3- methoxy- 4- (pentyloxy)phenyl]- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCCCCOc1ccc(cc1OC)C1C2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(=O)OCC

STK541633
Synonyms: (2E)- 3- (2- chloro- 6,7- dimethoxyquinolin- 3- yl)- 1- (thiophen- 2- yl)prop- 2- en- 1- one
Smiles: COc1cc2cc(/C=C/C(=O)c3cccs3)c(nc2cc1OC)Cl

STK541635
Synonyms: 2- {[3- (3- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N- (2- phenylethyl)acetamide
Smiles: COc1cccc(c1)n1c(SCC(=O)NCCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK541636
Synonyms: 3- ethyl- 5- {[4- (pentyloxy)benzyl]sulfanyl}- 4H- 1,2,4- triazole
Smiles: CCCCCOc1ccc(cc1)CSc1nnc([nH]1)CC

STK541637
Synonyms: N~6~- (2- chlorophenyl)- N~4~,N~4~- dimethyl- 7- nitro- 2,1,3- benzoxadiazole- 4,6- diamine
Smiles: [O-][N+](=O)c1c(Nc2ccccc2Cl)cc(c2c1non2)N(C)C

STK541638
Synonyms: 2- {[6,6- dimethyl- 3- (3- methylphenyl)- 4- oxo- 3,5,6,8- tetrahydro- 4H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(SC3)(C)C

STK541639
Synonyms: 2- [4- (2- chlorobenzyl)piperazin- 1- yl]- N'- [(1E)- 1- phenylethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccccc1Cl)N/N=C(/c1ccccc1)\C

STK541640
Synonyms: 2- ethyl- 3- (2- methoxyethyl)- 11- (4- methylphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COCCn1c(CC)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)C

STK541641
Synonyms: 2- (4- chloro- 3- nitrophenyl)- 4- (3- chlorophenyl)- 5- phenyl- 1H- imidazole
Smiles: Clc1cccc(c1)c1nc([nH]c1c1ccccc1)c1ccc(c(c1)[N+](=O)[O-])Cl

STK541642
Synonyms: 2- [(3- methylbutyl)sulfanyl]- 3- (3- methylphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CC(CCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCC3)C

STK541643
Synonyms: N- (2,4- dichlorophenyl)- 2- {[3- (3- methylphenyl)- 4- oxo- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C

STK541644
Synonyms: methyl4- (6- {[4- (acetylamino)phenyl]amino}- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc(cc1)NC(=O)C)c1ccccc1

STK541645
Synonyms: 3- cyclohexyl- 11- (3- methylphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Cc1cccc(c1)n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)C1CCCCC1

STK541646
Synonyms: (3aS,6aS)- 3,5- bis(4- nitrophenyl)- 1- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: O=C1[C@H]2N(N=C([C@H]2C(=O)N1c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK541647
Synonyms: 2- [4- (4- chlorobenzyl)piperazin- 1- yl]- N'- [(E)- (4- methylphenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)Cl)N/N=C/c1ccc(cc1)C

STK541648
Synonyms: (2E)- N- benzyl- 2- {5- bromo- 2- [(2,4- dichlorobenzyl)oxy]benzylidene}hydrazinecarbothioamide
Smiles: S=C(NCc1ccccc1)N/N=C/c1cc(Br)ccc1OCc1ccc(cc1Cl)Cl

STK541649
Synonyms: (4E)- 5- (4- ethoxyphenyl)- 4- (1- hydroxyethylidene)- 1- (2- methoxyethyl)pyrrolidine- 2,3- dione
Smiles: COCCN1C(=O)C(=O)/C(=C(/O)\C)/C1c1ccc(cc1)OCC

STK541650
Synonyms: N- (2- methylphenyl)- 2- {[5- (2- methylpropyl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl]sulfanyl}acetamide
Smiles: CC(Cc1nc2sc3c(c2c2c1CCCC2)ncnc3SCC(=O)Nc1ccccc1C)C

STK541651
Synonyms: diethyl3- methyl- 5- (phenylamino)biphenyl- 2,6- dicarboxylate
Smiles: CCOC(=O)c1c(Nc2ccccc2)cc(c(c1c1ccccc1)C(=O)OCC)C

STK541652
Synonyms: N- [1- (4- methoxybenzyl)- 3- (phenylsulfonyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl]naphthalene- 2- sulfonamide
Smiles: COc1ccc(cc1)Cn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc2c(c1)cccc2)S(=O)(=O)c1ccccc1

STK541653
Synonyms: 2- chloro- 6- methyl- 3- [3- (4- methylphenyl)- 1- (methylsulfonyl)- 4,5- dihydro- 1H- pyrazol- 5- yl]quinoline
Smiles: Cc1ccc(cc1)C1=NN(C(C1)c1cc2cc(C)ccc2nc1Cl)S(=O)(=O)C

STK541654
Synonyms: (2E)- 1- [5- (4- fluorophenyl)- 3- phenyl- 4,5- dihydro- 1H- pyrazol- 1- yl]- 3- phenylprop- 2- en- 1- one
Smiles: Fc1ccc(cc1)C1CC(=NN1C(=O)/C=C/c1ccccc1)c1ccccc1

STK541656
Synonyms: 2- ethyl- 3- methyl- 1- {4- [2- (4- methylphenoxy)ethyl]piperazin- 1- yl}pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(c1N1CCN(CC1)CCOc1ccc(cc1)C)c1ccccc1n2

STK541657
Synonyms: [3- (4- bromophenyl)- 5- (furan- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl](2- chlorophenyl)methanone
Smiles: Brc1ccc(cc1)C1=NN(C(C1)c1ccco1)C(=O)c1ccccc1Cl

STK541660
Synonyms: 3- {(Z)- [3- (1,3- benzodioxol- 5- ylmethyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (butan- 2- ylamino)- 9- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCC(Nc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2)C

STK541661
Synonyms: 2- amino- 1- (3,4- dimethoxyphenyl)- N- pentyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)OC)OC

STK541662
Synonyms: ethyl5- methoxy- 3- {[3- (thiomorpholin- 4- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCSCC1)cc(cc2)OC

STK541664
Synonyms: diethyl(6Z)- 2- (3,4- dimethoxyphenyl)- 4- hydroxy- 6- (hydroxyimino)- 4- methylcyclohexane- 1,3- dicarboxylate
Smiles: CCOC(=O)C1/C(=N\O)/CC(C(C1c1ccc(c(c1)OC)OC)C(=O)OCC)(C)O

STK541665
Synonyms: 2- [4- (4- chlorobenzyl)piperazin- 1- yl]- N'- [(1E,2Z)- 2- chloro- 3- phenylprop- 2- en- 1- ylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)Cl)N/N=C/C(=C/c1ccccc1)/Cl

STK541666
Synonyms: 9'- bromo- 2'- (2,4- dichlorophenyl)- 4- phenyl- 1',10b'- dihydrospiro[cyclohexane- 1,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: Brc1ccc2c(c1)C1CC(=NN1C1(O2)CCC(CC1)c1ccccc1)c1ccc(cc1Cl)Cl

STK541667
Synonyms: diphenylmethyl(6aR,6bS,9aR,10S)- 8- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxylate
Smiles: O=C([C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc3c(c1)OCCO3)C=Cc1c2cccc1)OC(c1ccccc1)c1ccccc1

STK541669
Synonyms: 8- benzyl- 4- (3- methylphenyl)- 1- {[4- (propan- 2- yloxy)benzyl]sulfanyl}- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CC(Oc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CCN(C3)Cc1ccccc1)C

STK541671
Synonyms: N- {[4'- (acetyloxy)biphenyl- 3- yl]carbonyl}glycine
Smiles: OC(=O)CNC(=O)c1cccc(c1)c1ccc(cc1)OC(=O)C

STK541672
Synonyms: N- [1- (1H- benzimidazol- 2- yl)- 3- (methylsulfanyl)propyl]- 4- chlorobenzamide
Smiles: CSCCC(c1nc2c([nH]1)cccc2)NC(=O)c1ccc(cc1)Cl

STK541673
Synonyms: 2- amino- 1- pentyl- N- (tetrahydrofuran- 2- ylmethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCC1CCCO1

STK541674
Synonyms: N- (4- methylphenyl)- 2- {[3- (3- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCCC3

STK541675
Synonyms: ethyl(3,3- dimethylbut- 1- yn- 1- yl)[phenyl(phenylamino)methyl]phosphinate
Smiles: CCOP(=O)(C(c1ccccc1)Nc1ccccc1)C#CC(C)(C)C

STK541676
Synonyms: N- [3- (4- fluorophenyl)- 3- (furan- 2- yl)propyl]benzenesulfonamide
Smiles: Fc1ccc(cc1)C(c1ccco1)CCNS(=O)(=O)c1ccccc1

STK541677
Synonyms: methyl(1R,2R,3S)- 1- [(4- chlorophenyl)carbonyl]- 3- cyano- 2- [4- (dimethylamino)phenyl]- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinoline- 3- carboxylate
Smiles: COC(=O)[C@@]1(C#N)[C@@H](c2ccc(cc2)N(C)C)[C@@H](N2C1C=Cc1c2cccc1)C(=O)c1ccc(cc1)Cl

STK541679
Synonyms: N- (3- methoxyphenyl)- 2- [(3,6,6- trimethyl- 4- oxo- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nc2sc3c(c2c(=O)n1C)CC(OC3)(C)C

STK541680
Synonyms: 6- chloro- 2- [3- (4- methylphenyl)- 5- (3- nitrophenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- phenylquinazoline
Smiles: Cc1ccc(cc1)C1=NN(C(C1)c1cccc(c1)[N+](=O)[O-])c1nc2ccc(cc2c(n1)c1ccccc1)Cl

STK541681
Synonyms: 6,6- dimethyl- 3- (4- methylphenyl)- 2- (propylsulfanyl)- 3,5,6,8- tetrahydro- 4H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(SC3)(C)C

STK541682
Synonyms: 2- [(1,3- benzodioxol- 5- ylmethyl)sulfanyl]- 8- ethyl- 8- methyl- 3- (4- methylphenyl)- 3,6,8,9- tetrahydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 4- one
Smiles: CCC1(C)OCc2c(C1)nc1c(c2)c(=O)n(c(n1)SCc1ccc2c(c1)OCO2)c1ccc(cc1)C

STK541683
Synonyms: (2Z)- 2- cyano- 2- [5- (3,4- dichlorobenzyl)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]- N- (3,4- dichlorophenyl)ethanamide
Smiles: N#C/C(=C\1/SC(C(=O)N1c1ccccc1)Cc1ccc(c(c1)Cl)Cl)/C(=O)Nc1ccc(c(c1)Cl)Cl

STK541684
Synonyms: 4,7- di(morpholin- 4- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: O1CCN(CC1)c1nc2sc3c(c2c2c1CCC2)ncnc3N1CCOCC1

STK541685
Synonyms: 1- (hexylsulfanyl)- 4- (2- phenylethyl)- 6,7,8,9- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CCCC3

STK541687
Synonyms: 2- propyl- 3- {[(E)- (3,4,5- trimethoxyphenyl)methylidene]amino}quinazolin- 4(3H)- one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1cc(OC)c(c(c1)OC)OC

STK541691
Synonyms: (6aR,6bS,9aR,10S)- 8- (1,3- benzodioxol- 5- yl)- 10- [(4- chlorophenyl)carbonyl]- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc3c(c1)OCO3)C=Cc1c2cccc1

STK541692
Synonyms: 11- (4- bromophenyl)- 3- (2- methoxyethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)Br

STK541693
Synonyms: 3- {(Z)- [3- (4- methoxybenzyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 9- methyl- 2- (thiomorpholin- 4- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: COc1ccc(cc1)CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCSCC2)/C1=O

STK541694
Synonyms: (2E)- 2- cyano- N- (4- methoxyphenyl)- 3- [5- (2- methylcyclopropyl)furan- 2- yl]prop- 2- enamide
Smiles: COc1ccc(cc1)NC(=O)/C(=C/c1ccc(o1)C1CC1C)/C#N

STK541695
Synonyms: 6- {(2E)- 2- [4- (benzyloxy)benzylidene]hydrazinyl}[1,2,4]triazolo[4,3- b]pyridazine
Smiles: c1ccc(cc1)COc1ccc(cc1)/C=N/Nc1ccc2n(n1)cnn2

STK541698
Synonyms: ethyl2- [(3E)- 3- [hydroxy(4- methoxy- 3- methylphenyl)methylidene]- 2- (2- methoxyphenyl)- 4,5- dioxopyrrolidin- 1- yl]- 4- methyl- 1,3- thiazole- 5- carboxylate
Smiles: CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/O)/C1c1ccccc1OC

STK541699
Synonyms: (6aR,6bS,9aR,10S)- 8- (2- chloro- 5- nitrophenyl)- 10- (phenylcarbonyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Clc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)c1ccccc1)[N+](=O)[O-]

STK541700
Synonyms: 2- (2,6- dimethylmorpholin- 4- yl)- 3- {(Z)- [3- (4- methoxybenzyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 9- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: COc1ccc(cc1)CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CC(C)OC(C2)C)/C1=O

STK541701
Synonyms: 2- {[2- (2- hydroxyethoxy)ethyl]amino}- 9- methyl- 3- {(Z)- [3- (4- methylbenzyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: OCCOCCNc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)C

STK541705
Synonyms: diphenylmethyl(6aR,6bS,9aR,10S)- 8- (3- fluorophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxylate
Smiles: Fc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)OC(c1ccccc1)c1ccccc1

STK541706
Synonyms: 2- amino- 1- (1,3- benzodioxol- 5- ylmethyl)- N- pentyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc2c(c1)OCO2

STK541707
Synonyms: 6- amino- 3- methyl- 1- (4- methylphenyl)- 4- [4- (propan- 2- yloxy)phenyl]- 1,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)OC(C)C)c(C)nn2c1ccc(cc1)C

STK541709
Synonyms: 4- (4- chlorophenyl)- 2- (4- nitrophenyl)- 5- phenyl- 1H- imidazole
Smiles: Clc1ccc(cc1)c1nc([nH]c1c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

STK541710
Synonyms: 2- [4- (4- chlorobenzyl)piperazin- 1- yl]- N'- [(E)- naphthalen- 1- ylmethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)Cl)N/N=C/c1cccc2c1cccc2

STK541711
Synonyms: 2- (4- {[4- (butoxycarbonyl)phenyl]carbamothioyl}piperazin- 1- yl)- 8- ethyl- 5- oxo- 5,8- dihydropyrido[2,3- d]pyrimidine- 6- carboxylicacid
Smiles: CCCCOC(=O)c1ccc(cc1)NC(=S)N1CCN(CC1)c1ncc2c(n1)n(CC)cc(c2=O)C(=O)O

STK541714
Synonyms: 2- {4- [(4- bromophenyl)sulfonyl]piperazin- 1- yl}- N'- [(E)- (2- fluorophenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C/c1ccccc1F

STK541715
Synonyms: (3aR,6aS)- 3- (3,4- dimethoxyphenyl)- 5- (4- nitrophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: COc1ccc(cc1OC)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-]

STK541716
Synonyms: (2E)- N- ethyl- 2- {2- [({5- [(4- methylbenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)acetyl]hydrazinylidene}ethanethioamide
Smiles: CCNC(=S)/C=N/NC(=O)CSc1nnc(s1)SCc1ccc(cc1)C

STK541717
Synonyms: 8- chloro- 4- (4- ethylpiperazin- 1- yl)- 5H- pyrimido[5,4- b]indole
Smiles: CCN1CCN(CC1)c1ncnc2c1[nH]c1c2cc(cc1)Cl

STK541718
Synonyms: (8S)- 2- acetyl- 6- amino- 8- (3- methoxy- 4- propoxyphenyl)- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: CCCOc1ccc(cc1OC)[C@@H]1C2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(=O)C

STK541719
Synonyms: methyl(1S,2R,3R)- 2- (4- bromophenyl)- 1- cyano- 3- (phenylcarbonyl)- 1,2,3,10b- tetrahydropyrrolo[2,1- a]isoquinoline- 1- carboxylate
Smiles: COC(=O)[C@@]1(C#N)[C@@H](c2ccc(cc2)Br)[C@@H](N2C1c1ccccc1C=C2)C(=O)c1ccccc1

STK541720
Synonyms: 2,7- bis(3- bromophenyl)- 2,4,5,7,9,10- hexahydrocycloocta[1,2- c:5,6- c']dipyrrole
Smiles: Brc1cccc(c1)n1cc2c(c1)CCc1c(CC2)cn(c1)c1cccc(c1)Br

STK541721
Synonyms: 2- amino- 1- (4- ethoxyphenyl)- N- (prop- 2- en- 1- yl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: C=CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)OCC

STK541722
Synonyms: (3aR,4S,9aR,9bS)- 4- [(4- bromophenyl)carbonyl]- 2- (2,4- dichlorophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Brc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1Cl)Cl)C(=O)c1ccccc1

STK541723
Synonyms: (3aR,6aS)- 5- (4- bromophenyl)- 3- (4- nitrophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: Brc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)ON=C2c1ccc(cc1)[N+](=O)[O-]

STK541725
Synonyms: 3- {(Z)- [4- oxo- 3- (2- phenylethyl)- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (thiomorpholin- 4- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: S=C1S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCSCC2)/C(=O)N1CCc1ccccc1

STK541726
Synonyms: (2E)- 2- cyano- 3- (2- hydroxy- 5- methoxyphenyl)- N- (pyridin- 3- yl)prop- 2- enamide
Smiles: COc1ccc(c(c1)/C=C(/C(=O)Nc1cccnc1)\C#N)O

STK541729
Synonyms: 4- (3- bromophenyl)- 2- (4- butoxyphenyl)- 6H- 1,3- oxazin- 6- one
Smiles: CCCCOc1ccc(cc1)c1oc(=O)cc(n1)c1cccc(c1)Br

STK541731
Synonyms: diphenylmethyl(8S,8aR,11aS)- 9,11- dioxo- 10- phenyl- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 8- carboxylate
Smiles: O=C([C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1)cccc3)OC(c1ccccc1)c1ccccc1

STK541732
Synonyms: (4E)- 1- [2- (dimethylamino)ethyl]- 4- [hydroxy(4- methylphenyl)methylidene]- 5- phenylpyrrolidine- 2,3- dione
Smiles: CN(CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccccc1)C

STK541733
Synonyms: 2- {[3- (3- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: COc1cccc(c1)n1c(SCC(=O)Nc2cccc3c2cccc3)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK541734
Synonyms: [(1R,2S,3R,3aR)- 2- (4- bromophenyl)- 3- nitro- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinolin- 1- yl](4- chlorophenyl)methanone
Smiles: Clc1ccc(cc1)C(=O)[C@H]1[C@H](c2ccc(cc2)Br)[C@H]([C@@H]2N1c1ccccc1C=C2)[N+](=O)[O-]

STK541735
Synonyms: 1- (4- methoxybenzyl)- N- (2- phenylethyl)- 2- [(phenylsulfonyl)amino]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccc(cc1)Cn1c(NS(=O)(=O)c2ccccc2)c(c2c1nc1ccccc1n2)C(=O)NCCc1ccccc1

STK541737
Synonyms: 1- (furan- 2- ylmethyl)- 2- imino- 10- methyl- 5- oxo- N- (prop- 2- en- 1- yl)- 1,5- dihydro- 2H- dipyrido[1,2- a:2',3'- d]pyrimidine- 3- carboxamide
Smiles: C=CCNC(=O)c1cc2c(n(c1=N)Cc1ccco1)nc1n(c2=O)cccc1C

STK541738
Synonyms: 9- [(3- bromobenzyl)sulfanyl]- 8- (4- methoxyphenyl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: COc1ccc(cc1)n1c(SCc2cccc(c2)Br)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK541739
Synonyms: ethyl(8R,8aR)- 6- amino- 5,7,7- tricyano- 8- (2- fluorophenyl)- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1ccccc1F)C(C(=C2C#N)N)(C#N)C#N

STK541740
Synonyms: 2- [4- (benzyloxy)- 3- methoxyphenyl]- 5- (2- methyl- 5- nitrophenyl)- 4- phenyl- 1H- imidazole
Smiles: COc1cc(ccc1OCc1ccccc1)c1[nH]c(c(n1)c1ccccc1)c1cc(ccc1C)[N+](=O)[O-]

STK541742
Synonyms: 3- {(Z)- [3- (1,3- benzodioxol- 5- ylmethyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- [(3- hydroxypropyl)amino]- 7- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: OCCCNc1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2)C

STK541743
Synonyms: ethyl2- {[(2Z)- 2- cyano- 3- (2- hydroxyphenyl)prop- 2- enoyl]amino}- 4- (4- fluorophenyl)thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccc(cc1)F)NC(=O)/C(=C\c1ccccc1O)/C#N

STK541744
Synonyms: 8- (benzyloxy)- 2,2- dimethyl- 5- (morpholin- 4- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CC1(C)OCc2c(C1)c1c(nc2N2CCOCC2)sc2c1ncnc2OCc1ccccc1

STK541746
Synonyms: (8S,8aR,11aS)- N- (4- chlorophenyl)- 10- (naphthalen- 2- yl)- 9,11- dioxo- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 8- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)cccc2)cccc3

STK541747
Synonyms: ethyl3- [(benzylcarbamothioyl)amino]- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=S)NCc1ccccc1)cc(cc2)OC

STK541748
Synonyms: 3- benzyl- 5- ethyl- 5- methyl- 2- (propan- 2- ylsulfanyl)- 5,6- dihydrobenzo[h]quinazolin- 4(3H)- one
Smiles: CCC1(C)Cc2ccccc2c2c1c(=O)n(c(n2)SC(C)C)Cc1ccccc1

STK541750
Synonyms: 3- (2- phenylethyl)- 6- (propan- 2- yl)- 2- (prop- 2- en- 1- ylsulfanyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: C=CCSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CC(OC3)C(C)C

STK541751
Synonyms: (8S,8aR,11aS)- 10- (2- chlorophenyl)- N- (4- chlorophenyl)- 9,11- dioxo- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 8- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1Cl)cccc3

STK541752
Synonyms: N'- (1- benzyl- 1H- pyrazolo[3,4- d]pyrimidin- 4- yl)- 2- (4- methoxyphenyl)acetohydrazide
Smiles: COc1ccc(cc1)CC(=O)NNc1ncnc2c1cnn2Cc1ccccc1

STK541753
Synonyms: 2- cyano- 2- [3- (dibutylamino)quinoxalin- 2- yl]- N- hexylacetamide
Smiles: CCCCCCNC(=O)C(c1nc2ccccc2nc1N(CCCC)CCCC)C#N

STK541754
Synonyms: 4- oxo- 4- [3- phenyl- 5- (quinoxalin- 6- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]butanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccc2c(c1)nccn2)c1ccccc1

STK541755
Synonyms: methyl3- {[(4- methoxyphenyl)carbamoyl]amino}- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COc1ccc(cc1)NC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC

STK541756
Synonyms: 3- benzyl- 2- {[2- oxo- 2- (piperidin- 1- yl)ethyl]sulfanyl}- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: O=C(N1CCCCC1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3

STK541757
Synonyms: 2- (3- bromophenyl)- 1- (4- chlorophenyl)- 1H- imidazo[4,5- b]quinoxaline
Smiles: Brc1cccc(c1)c1nc2c(n1c1ccc(cc1)Cl)nc1c(n2)cccc1

STK541758
Synonyms: methyl4- {2- [(2E)- 2- (3,4- dimethoxybenzylidene)hydrazinyl]- 2- oxoethoxy}benzoate
Smiles: COC(=O)c1ccc(cc1)OCC(=O)N/N=C/c1ccc(c(c1)OC)OC

STK541760
Synonyms: 11- (3- bromophenyl)- N- (3- chlorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Brc1cccc(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cccc(c1)Cl)c1ccccc1

STK541761
Synonyms: 3- {(Z)- [3- (4- fluorobenzyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- {[3- (1H- imidazol- 1- yl)propyl]amino}- 9- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: Fc1ccc(cc1)CN1C(=S)S/C(=C\c2c(NCCCn3cncc3)nc3n(c2=O)cccc3C)/C1=O

STK541762
Synonyms: 11- (4- chlorophenyl)- N- (4- methoxyphenyl)- 10- methyl- 8- (4- nitrophenyl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccc(cc1)Cl)C)c1ccc(cc1)[N+](=O)[O-]

STK541764
Synonyms: methyl2- ({3- [4- (diphenylmethyl)piperazin- 1- yl]quinoxalin- 2- yl}amino)- 4,5- dimethylthiophene- 3- carboxylate
Smiles: COC(=O)c1c(Nc2nc3ccccc3nc2N2CCN(CC2)C(c2ccccc2)c2ccccc2)sc(c1C)C

STK541765
Synonyms: ethyl3- {[(3,4- dimethoxyphenyl)carbonyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)c1ccc(c(c1)OC)OC)cc(cc2)OC

STK541766
Synonyms: 4- hexyl- 3- methyl- 2,6- bis(4- methylphenyl)piperidin- 4- ol
Smiles: CCCCCCC1(O)CC(NC(C1C)c1ccc(cc1)C)c1ccc(cc1)C

STK541767
Synonyms: (6aR,6bS,9aR,10S)- 8- (4- bromophenyl)- N- (4- chlorophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)[C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc(cc1)Br)C=Cc1c2cccc1

STK541769
Synonyms: (4Z)- 4- (1- hydroxyethylidene)- 1- (4- methoxyphenyl)- 5- (3- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)N1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/O)\C)/C(=O)C1=O

STK541770
Synonyms: N- (3,4- dichlorophenyl)- 2- [(4- phenyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CSc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK541771
Synonyms: 2- [(3- benzyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N- (2- phenylethyl)acetamide
Smiles: O=C(CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3)NCCc1ccccc1

STK541773
Synonyms: 3- {(Z)- [3- (3- ethoxypropyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- [(2- hydroxyethyl)amino]- 7- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: OCCNc1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCCOCC)C

STK541774
Synonyms: 2- [(E)- 2- (4- methylphenyl)ethenyl]- 3- phenylquinazolin- 4(3H)- one
Smiles: Cc1ccc(cc1)/C=C/c1nc2ccccc2c(=O)n1c1ccccc1

STK541775
Synonyms: 2- [(4- amino- 6,6- dimethyl- 5,8- dihydro- 6H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- (4- phenylbutan- 2- yl)acetamide
Smiles: CC(NC(=O)CSc1nc(N)c2c(n1)sc1c2CC(SC1)(C)C)CCc1ccccc1

STK541776
Synonyms: ethyl2- {[3- ethoxy- 1,1,1- trifluoro- 3- oxo- 2- (pentanoylamino)propan- 2- yl]amino}- 1,3- benzothiazole- 6- carboxylate
Smiles: CCCCC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1sc2c(n1)ccc(c2)C(=O)OCC

STK541777
Synonyms: N- cyclohexyl- 4- phenyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- amine
Smiles: C1CCC(CC1)Nc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK541778
Synonyms: 3,7- bis[(1,3- benzodioxol- 5- ylmethyl)sulfanyl]- 11- tert- butyl- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:4',3'- c]pyrimidine
Smiles: CC(C1CCc2c(C1)sc1c2c2nnc(n2c2n1c(SCc1ccc3c(c1)OCO3)nn2)SCc1ccc2c(c1)OCO2)(C)C

STK541779
Synonyms: 2,2- dimethyl- N'- [(8- methyl- 1,2,3a,4,5,6- hexahydro- 3H- pyrazino[3,2,1- jk]carbazol- 3- yl)acetyl]propanehydrazide
Smiles: O=C(CN1CCn2c3C1CCCc3c1c2ccc(c1)C)NNC(=O)C(C)(C)C

STK541780
Synonyms: 3- benzyl- 2- [(Z)- (5- bromo- 1- methyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)methyl]- 6- iodoquinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C\1/c2cc(Br)ccc2N(C1=O)C)Cc1ccccc1

STK541781
Synonyms: 8- ethoxy- 2,2- dimethyl- 5- (propan- 2- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CCOc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C(C)C

STK541782
Synonyms: 2- [(4- methyl- 5- phenyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N- (2- {[2- oxo- 2- (1,2,3,4- tetrahydro- 9H- carbazol- 9- yl)ethyl]sulfanyl}- 1,3- benzothiazol- 6- yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)n1c2CCCCc2c2c1cccc2)CSc1nnc(n1C)c1ccccc1

STK541783
Synonyms: 3,6- diamino- N- {2- [(3- bromobenzyl)sulfanyl]phenyl}- 5- cyanothieno[2,3- b]pyridine- 2- carboxamide
Smiles: N#Cc1cc2c(nc1N)sc(c2N)C(=O)Nc1ccccc1SCc1cccc(c1)Br

STK541785
Synonyms: 2- amino- 1- (1,3- benzodioxol- 5- yl)- N- (2- methoxybenzyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1ccccc1CNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc2c(c1)OCO2

STK541786
Synonyms: (4S,4aR)- 2- amino- 4- (3,4- diethoxyphenyl)- 4a,5,6,7- tetrahydronaphthalene- 1,3,3(4H)- tricarbonitrile
Smiles: CCOc1cc(ccc1OCC)[C@@H]1[C@H]2CCCC=C2C(=C(C1(C#N)C#N)N)C#N

STK541787
Synonyms: 6- chloro- 2- [(2E)- 2- (4- fluorobenzylidene)hydrazinyl]- 1,3- benzoxazole
Smiles: Fc1ccc(cc1)/C=N/Nc1nc2c(o1)cc(cc2)Cl

STK541788
Synonyms: N'- {(E)- [4- (dimethylamino)phenyl]methylidene}- 2- [4- (4- methylbenzyl)piperazin- 1- yl]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)C)N/N=C/c1ccc(cc1)N(C)C

STK541789
Synonyms: 3- ({(E)- [4- (decyloxy)phenyl]methylidene}amino)- 2,8- dimethyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCCCCCCCCCOc1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cc(cc1)C

STK541790
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N'- {(E)- [4- (pentyloxy)phenyl]methylidene}acetohydrazide
Smiles: CCCCCOc1ccc(cc1)/C=N/NC(=O)CSc1nnc(s1)SCc1ccccc1

STK541792
Synonyms: ethyl3- {[(4- fluorophenyl)carbamothioyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=S)Nc1ccc(cc1)F)cc(cc2)OC

STK541794
Synonyms: 2- (butylsulfanyl)- 6- iodo- 3- (2- methylphenyl)quinazolin- 4(3H)- one
Smiles: CCCCSc1nc2ccc(cc2c(=O)n1c1ccccc1C)I

STK541795
Synonyms: 3- benzyl- 5- ethyl- 5- methyl- 2- [(3- methylbutyl)sulfanyl]- 5,6- dihydrobenzo[h]quinazolin- 4(3H)- one
Smiles: CCC1(C)Cc2ccccc2c2c1c(=O)n(c(n2)SCCC(C)C)Cc1ccccc1

STK541796
Synonyms: 2- (3,4- dimethoxyphenyl)- 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: COc1cc(ccc1OC)c1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

STK541797
Synonyms: 4- amino- 6- methyl- 2- (trifluoromethyl)quinoline- 3- carbonitrile
Smiles: N#Cc1c(N)c2cc(C)ccc2nc1C(F)(F)F

STK541799
Synonyms: ethyl5- bromo- 3- ({3- [4- (2- fluorophenyl)piperazin- 1- yl]propanoyl}amino)- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1F)cc(cc2)Br

STK541800
Synonyms: 1- (3- chlorophenyl)- 2- (4- nitrophenyl)- 1H- imidazo[4,5- b]quinoxaline
Smiles: Clc1cccc(c1)n1c(nc2c1nc1ccccc1n2)c1ccc(cc1)[N+](=O)[O-]

STK541801
Synonyms: (4E)- 5- (2,4- dichlorophenyl)- 4- [hydroxy(4- methoxy- 2- methylphenyl)methylidene]- 1- (pyridin- 3- ylmethyl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(c(c1)C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1Cl)Cl)Cc1cccnc1)/O

STK541802
Synonyms: diphenylmethyl(6aR,6bS,9aR,10S)- 8- (naphthalen- 1- yl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxylate
Smiles: O=C([C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1cccc3c1cccc3)C=Cc1c2cccc1)OC(c1ccccc1)c1ccccc1

STK541803
Synonyms: 3- {(Z)- [3- (butan- 2- yl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- {[3- (1H- imidazol- 1- yl)propyl]amino}- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCC(N1C(=S)S/C(=C\c2c(NCCCn3ccnc3)nc3n(c2=O)cccc3)/C1=O)C

STK541804
Synonyms: methyl[(4- phenyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl)sulfanyl]acetate
Smiles: COC(=O)CSc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK541805
Synonyms: N'- [(1E)- 1- (2- hydroxyphenyl)ethylidene]- 2- [(4- oxo- 3- phenyl- 3,4- dihydroquinazolin- 2- yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccccc1)N/N=C(/c1ccccc1O)\C

STK541806
Synonyms: 11- [2- (cyclohex- 1- en- 1- yl)ethyl]- 3- cyclohexyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: O=c1c2c(ncn1C1CCCCC1)n(c1c2nc2ccccc2n1)CCC1=CCCCC1

STK541807
Synonyms: N'- [(E)- (2- chloro- 5- nitrophenyl)methylidene]- 2- {[5- (3,4- dimethoxyphenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: COc1cc(ccc1OC)c1nnc(n1CC)SCC(=O)N/N=C/c1cc(ccc1Cl)[N+](=O)[O-]

STK541808
Synonyms: 3- (3- methoxyphenyl)- 2- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: COc1cccc(c1)n1c(SCC(=C)C)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK541809
Synonyms: 2,2'- (11,12- dihydro- 10H- cyclopenta[4,5]thieno[3,2- e]bis[1,2,4]triazolo[4,3- a:4',3'- c]pyrimidine- 3,7- diyldisulfanediyl)diacetamide
Smiles: NC(=O)CSc1nnc2n1c1sc3c(c1c1n2c(SCC(=O)N)nn1)CCC3

STK541811
Synonyms: (4E)- 1- [2- (dimethylamino)ethyl]- 5- [4- (dimethylamino)phenyl]- 4- [hydroxy(4- methoxyphenyl)methylidene]pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)N(C)C)CCN(C)C)/O

STK541814
Synonyms: 9'- bromo- 2'- (4- fluorophenyl)- 2,2- dimethyl- 1',2,3,5,6,10b'- hexahydrospiro[pyran- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: Fc1ccc(cc1)C1=NN2C(C1)c1cc(Br)ccc1OC12CCOC(C1)(C)C

STK541815
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 3- (3- methylphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Cc1cccc(c1)n1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK541818
Synonyms: 2- (hexylsulfanyl)- 8,8- dimethyl- 3- (4- methylphenyl)- 3,6,8,9- tetrahydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 4- one
Smiles: CCCCCCSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1ccc(cc1)C

STK541819
Synonyms: 3- {(Z)- [3- (4- methylbenzyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (thiomorpholin- 4- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: Cc1ccc(cc1)CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCSCC2)/C1=O

STK541820
Synonyms: (2E)- 2- cyano- 3- (4- hydroxy- 3- methoxyphenyl)- N- (2- iodophenyl)prop- 2- enamide
Smiles: N#C/C(=C\c1ccc(c(c1)OC)O)/C(=O)Nc1ccccc1I

STK541821
Synonyms: 3,7- bis[(3,5- dinitrophenyl)carbonyl]- 1,5- dimethyl- 3,7- diazabicyclo[3.3.1]nonan- 9- one
Smiles: O=C(c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])N1CC2(C)CN(CC(C1)(C2=O)C)C(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]

STK541823
Synonyms: 3- (butylsulfanyl)- 8,8- dimethyl- 11- (morpholin- 4- yl)- 7,10- dihydro- 8H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[2,3- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CCCCSc1nnc2n1cnc1c2sc2c1c1CC(C)(C)OCc1c(n2)N1CCOCC1

STK541824
Synonyms: 1,1'- (2,8- dibromo- 4b,9b- diphenyl- 4b,9b- dihydroindolo[3,2- b]indole- 5,10- diyl)diethanone
Smiles: Brc1ccc2c(c1)N(C(=O)C)C1(C2(c2ccccc2)N(C(=O)C)c2c1cc(cc2)Br)c1ccccc1

STK541826
Synonyms: 2- methyl- N- (pyridin- 3- ylmethyl)- 5- (4- {[3- (trifluoromethyl)phenyl]amino}phthalazin- 1- yl)benzenesulfonamide
Smiles: Cc1ccc(cc1S(=O)(=O)NCc1cccnc1)c1nnc(c2c1cccc2)Nc1cccc(c1)C(F)(F)F

STK541827
Synonyms: N- (4- acetylphenyl)- 2- [(4- methyl- 5- oxo- 4,5,6,7,8,9- hexahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(=O)C)CSc1nnc2n1c1sc3c(c1c(=O)n2C)CCCC3

STK541828
Synonyms: 4- butoxy- N'- [(E)- 1H- indol- 3- ylmethylidene]benzohydrazide
Smiles: CCCCOc1ccc(cc1)C(=O)N/N=C/c1c[nH]c2c1cccc2

STK541830
Synonyms: N'- {(E)- [4- (diethylamino)phenyl]methylidene}- 2- [4- (4- methylbenzyl)piperazin- 1- yl]acetohydrazide
Smiles: CCN(c1ccc(cc1)/C=N/NC(=O)CN1CCN(CC1)Cc1ccc(cc1)C)CC

STK541831
Synonyms: 2- iodo- N- {[4- (2- methoxyphenyl)piperazin- 1- yl]carbonothioyl}benzamide
Smiles: COc1ccccc1N1CCN(CC1)C(=S)NC(=O)c1ccccc1I

STK541832
Synonyms: N'- [(E)- 1,3- benzodioxol- 5- ylmethylidene]- 4- (benzyloxy)benzohydrazide
Smiles: O=C(c1ccc(cc1)OCc1ccccc1)N/N=C/c1ccc2c(c1)OCO2

STK541835
Synonyms: N- (furan- 2- ylmethyl)- 2- {[5- oxo- 4- (2- phenylethyl)- 7- (propan- 2- yl)- 4,5,6,9- tetrahydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}acetamide
Smiles: O=C(NCc1ccco1)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CC(OC3)C(C)C

STK541838
Synonyms: 2- [(2- methylphenoxy)methyl]- 3- {[(E)- (3- nitrophenyl)methylidene]amino}quinazolin- 4(3H)- one
Smiles: Cc1ccccc1OCc1nc2ccccc2c(=O)n1/N=C/c1cccc(c1)[N+](=O)[O-]

STK541841
Synonyms: 3- (3- methoxyphenyl)- 2- (prop- 2- en- 1- ylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: C=CCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)OC)CCCC3

STK541842
Synonyms: 2- [(3- ethyl- 4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (2- nitrophenyl)acetamide
Smiles: CCc1c(=O)oc2c(c1C)ccc(c2)OCC(=O)Nc1ccccc1[N+](=O)[O-]

STK541843
Synonyms: 2- {[3- (morpholin- 4- yl)propyl]amino}- 3- {(Z)- [4- oxo- 3- (1- phenylethyl)- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: S=C1S/C(=C\c2c(NCCCN3CCOCC3)nc3n(c2=O)cccc3)/C(=O)N1C(c1ccccc1)C

STK541845
Synonyms: N'- [(E)- (3,5- dimethyl- 1- phenyl- 1H- pyrazol- 4- yl)methylidene]- 2- ({5- [(4- methylbenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccc(cc1)C)N/N=C/c1c(C)nn(c1C)c1ccccc1

STK541846
Synonyms: 2- [(2,4- dichlorobenzyl)sulfanyl]- 3- phenyl- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: Clc1ccc(c(c1)Cl)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCC3

STK541848
Synonyms: methyl4- methyl- 5- phenyl- 2- {[(3,4,5- trimethoxyphenyl)carbonyl]amino}thiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC(=O)c2cc(OC)c(c(c2)OC)OC)sc(c1C)c1ccccc1

STK541849
Synonyms: 1- (naphthalen- 1- yl)- 3- [(2- phenylethyl)amino]pyrrolidine- 2,5- dione
Smiles: O=C1CC(C(=O)N1c1cccc2c1cccc2)NCCc1ccccc1

STK541850
Synonyms: N'- [(1E)- 1- (4- bromophenyl)ethylidene]- 2- [4- (4- chlorobenzyl)piperazin- 1- yl]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)Cl)N/N=C(/c1ccc(cc1)Br)\C

STK541851
Synonyms: 2- [(3- cyclohexyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]- N- (3- methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1C1CCCCC1)CCCCC3

STK541852
Synonyms: 11- (2- fluorophenyl)- N- (4- methoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccccc2F)c(nn1c1ccccc1)C

STK541853
Synonyms: N- (4- methoxyphenyl)- 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3

STK541854
Synonyms: ethyl5- methoxy- 3- [(prop- 2- en- 1- ylcarbamothioyl)amino]- 1H- indole- 2- carboxylate
Smiles: C=CCNC(=S)Nc1c([nH]c2c1cc(OC)cc2)C(=O)OCC

STK541855
Synonyms: 3- (3- methylphenyl)- 2- (propan- 2- ylsulfanyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CC(Sc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCC3)C

STK541856
Synonyms: (6aR,6bS,9aR,10S)- 8- (2- methyl- 5- nitrophenyl)- 10- (phenylcarbonyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Cc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)c1ccccc1)[N+](=O)[O-]

STK541857
Synonyms: tert- butyl(8S,8aR)- 6- amino- 5,7,7- tricyano- 8- (3,4- diethoxyphenyl)- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCOc1cc(ccc1OCC)[C@@H]1[C@H]2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(=O)OC(C)(C)C

STK541858
Synonyms: (4Z)- 1- hexyl- 4- (1- hydroxyethylidene)- 5- (4- methylphenyl)pyrrolidine- 2,3- dione
Smiles: CCCCCCN1C(c2ccc(cc2)C)/C(=C(/O)\C)/C(=O)C1=O

STK541859
Synonyms: ethyl1- {[(E)- ethoxymethylidene]amino}- 5- phenyl- 7,8- dihydro- 6H- cyclopenta[d]thieno[2,3- b]pyridine- 2- carboxylate
Smiles: CCOC(=O)c1sc2c(c1/N=C/OCC)c1CCCc1c(n2)c1ccccc1

STK541860
Synonyms: 6,6- dimethyl- 3- (4- methylphenyl)- 2- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 3,5,6,8- tetrahydro- 4H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CC(=C)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(SC3)(C)C

STK541861
Synonyms: N- hexyl- 2,2- dimethyl- 5- (morpholin- 4- yl)- 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: CCCCCCNc1nnnc2c1sc1c2c2CC(C)(C)SCc2c(n1)N1CCOCC1

STK541863
Synonyms: 2- (4- bromo- 3- nitrophenyl)- 4- (3- chlorophenyl)- 5- phenyl- 1H- imidazole
Smiles: Clc1cccc(c1)c1nc([nH]c1c1ccccc1)c1ccc(c(c1)[N+](=O)[O-])Br

STK541867
Synonyms: N- (4- methoxyphenyl)- 10- methyl- 8,11- diphenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccccc2)c(nn1c1ccccc1)C

STK541868
Synonyms: 8- bromo- 4- (morpholin- 4- yl)- 5,6- dihydropyrimido[4,5- b][1,4]benzoxazepine
Smiles: Brc1ccc2c(c1)CNc1c(O2)ncnc1N1CCOCC1

STK541869
Synonyms: 7,7- dimethyl- 4- (3- methylphenyl)- 1- (methylsulfanyl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CC(OC3)(C)C

STK541871
Synonyms: 5- [5- (3- nitrophenyl)- 3- phenyl- 4,5- dihydro- 1H- pyrazol- 1- yl]- 5- oxopentanoicacid
Smiles: OC(=O)CCCC(=O)N1N=C(CC1c1cccc(c1)[N+](=O)[O-])c1ccccc1

STK541872
Synonyms: N- phenyl- 2- [(4- phenyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccccc1)CSc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK541873
Synonyms: N- benzyl- N- methyl- 5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- amine
Smiles: CN(c1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1)Cc1ccccc1

STK541874
Synonyms: 2- cyano- N- cyclopropyl- 2- (3- {4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}quinoxalin- 2- yl)acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCN(CC1)C/C=C/c1ccccc1)C(=O)NC1CC1

STK541877
Synonyms: N~6~- benzyl- N~4~,N~4~- dibutyl- 7- nitro- 2,1,3- benzoxadiazole- 4,6- diamine
Smiles: CCCCN(c1cc(NCc2ccccc2)c(c2c1non2)[N+](=O)[O-])CCCC

STK541878
Synonyms: 2,2'- {[3- nitro- 4- (pentyloxy)benzyl]imino}diethanol
Smiles: CCCCCOc1ccc(cc1[N+](=O)[O-])CN(CCO)CCO

STK541879
Synonyms: 7- methoxy- 4- phenyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: COc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK541881
Synonyms: ethyl3- {[3- (3,4- dihydroisoquinolin- 2(1H)- yl)propanoyl]amino}- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCc3c(C1)cccc3)cc(cc2)F

STK541882
Synonyms: ethyl5- fluoro- 3- {[3- (piperidin- 1- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCCCC1)cc(cc2)F

STK541883
Synonyms: ethyl3- [(N,N- diethyl- beta- alanyl)amino]- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN(CC)CC)cc(cc2)F

STK541884
Synonyms: 2- [(E)- 2- (2,4- dichlorophenyl)ethenyl]quinoline
Smiles: Clc1ccc(c(c1)Cl)/C=C/c1ccc2c(n1)cccc2

STK541886
Synonyms: N'- [(E)- (2- chlorophenyl)methylidene]- 2- {[5- (3,4- dimethoxyphenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: COc1cc(ccc1OC)c1nnc(n1CC)SCC(=O)N/N=C/c1ccccc1Cl

STK541887
Synonyms: methyl4- [6- amino- 5- cyano- 3- (trifluoromethyl)- 2,4- dihydropyrano[2,3- c]pyrazol- 4- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1C(=C(N)Oc2c1c([nH]n2)C(F)(F)F)C#N

STK541888
Synonyms: (3E)- 5,5- dimethyl- 3- [(4- methylphenyl)imino]cyclohex- 1- en- 1- ol
Smiles: OC1=C/C(=N/c2ccc(cc2)C)/CC(C1)(C)C

STK541889
Synonyms: {(1S,2R,3S)- 2- [4- (dimethylamino)phenyl]- 1- nitro- 1,2,3,10b- tetrahydropyrrolo[2,1- a]phthalazin- 3- yl}(phenyl)methanone
Smiles: O=C([C@H]1N2N=Cc3c(C2[C@H]([C@@H]1c1ccc(cc1)N(C)C)[N+](=O)[O-])cccc3)c1ccccc1

STK541892
Synonyms: 8- [(dimethylamino)methyl]- 7- hydroxy- 3- (naphthalen- 2- yloxy)- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CN(Cc1c(O)ccc2c1oc(c(c2=O)Oc1ccc2c(c1)cccc2)C(F)(F)F)C

STK541893
Synonyms: N- (2- methylpropyl)- 4- phenyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- amine
Smiles: CC(CNc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1)C

STK541894
Synonyms: 2,2'- (11,12- dihydro- 10H- cyclopenta[4,5]thieno[3,2- e]bis[1,2,4]triazolo[4,3- a:4',3'- c]pyrimidine- 3,7- diyldisulfanediyl)bis[N- (pyridin- 2- yl)acetamide]
Smiles: O=C(Nc1ccccn1)CSc1nnc2n1c1sc3c(c1c1n2c(SCC(=O)Nc2ccccn2)nn1)CCC3

STK541895
Synonyms: N- benzyl- 2- (6- bromo- 2- methyl- 4- oxoquinolin- 1(4H)- yl)acetamide
Smiles: O=C(Cn1c(C)cc(=O)c2c1ccc(c2)Br)NCc1ccccc1

STK541897
Synonyms: [(4- amino- 5- methyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]aceticacid
Smiles: Cc1nnc(n1N)SCC(=O)O

STK541899
Synonyms: 2- [(4- methoxybenzyl)sulfanyl]- 6,6- dimethyl- 3- (2- phenylethyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: COc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CC(OC3)(C)C

STK541900
Synonyms: 4- [3- (4- chlorophenyl)- 1- (6- chloro- 4- phenylquinazolin- 2- yl)- 4,5- dihydro- 1H- pyrazol- 5- yl]- N,N- dimethylaniline
Smiles: Clc1ccc(cc1)C1=NN(C(C1)c1ccc(cc1)N(C)C)c1nc2ccc(cc2c(n1)c1ccccc1)Cl

STK541901
Synonyms: (3E)- 4- [(2- {[2,3,5,6- tetrafluoro- 4- (hydroxymethyl)phenyl]amino}ethyl)amino]pent- 3- en- 2- one
Smiles: OCc1c(F)c(F)c(c(c1F)F)NCCN/C(=C/C(=O)C)/C

STK541902
Synonyms: 2- [4- (2- chlorobenzyl)piperazin- 1- yl]- N'- [(E)- thiophen- 2- ylmethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccccc1Cl)N/N=C/c1cccs1

STK541903
Synonyms: 3,7- bis[(2- nitrophenyl)carbonyl]- 1,5- di(propan- 2- yl)- 3,7- diazabicyclo[3.3.1]nonan- 9- one
Smiles: CC(C12CN(CC(C2=O)(CN(C1)C(=O)c1ccccc1[N+](=O)[O-])C(C)C)C(=O)c1ccccc1[N+](=O)[O-])C

STK541904
Synonyms: 3- benzyl- 2- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 6- iodoquinazolin- 4(3H)- one
Smiles: Brc1ccc(cc1)C(=O)CSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)I

STK541905
Synonyms: 2- (benzylsulfanyl)- 6- iodo- 3- (2- methylphenyl)quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)SCc1ccccc1)c1ccccc1C

STK541906
Synonyms: (2E)- 3- (7- chloro- 2,3- dihydro[1,4]dioxino[2,3- g]quinolin- 8- yl)- 1- (thiophen- 2- yl)prop- 2- en- 1- one
Smiles: Clc1nc2cc3OCCOc3cc2cc1/C=C/C(=O)c1cccs1

STK541907
Synonyms: 6- {[4,6- bis(dimethylamino)- 1,3,5- triazin- 2- yl]oxy}pyridazin- 3- ol
Smiles: Oc1ccc(nn1)Oc1nc(nc(n1)N(C)C)N(C)C

STK541908
Synonyms: 2- {[6,6- dimethyl- 4- oxo- 3- (2- phenylethyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- (4- phenylbutan- 2- yl)acetamide
Smiles: CC(NC(=O)CSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CC(OC3)(C)C)CCc1ccccc1

STK541909
Synonyms: 4- [5- (2- chloro- 6- methylquinolin- 3- yl)- 3- (3,4- dimethoxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- oxobutanoicacid
Smiles: COc1cc(ccc1OC)C1=NN(C(C1)c1cc2cc(C)ccc2nc1Cl)C(=O)CCC(=O)O

STK541911
Synonyms: N- (3,4- dichlorophenyl)- 2- [(4- methyl- 2- oxo- 2H- chromen- 6- yl)oxy]acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)COc1ccc2c(c1)c(C)cc(=O)o2

STK541913
Synonyms: 2- [3- (azepan- 1- yl)quinoxalin- 2- yl]- N- benzyl- 2- cyanoacetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCCCCC1)C(=O)NCc1ccccc1

STK541915
Synonyms: N- (3- methoxyphenyl)- 2- {[3- (3- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCCC3

STK541920
Synonyms: N- [(1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- yl)carbamothioyl]furan- 2- carboxamide
Smiles: S=C(Nc1cc(=O)n(c(=O)n1C)C)NC(=O)c1ccco1

STK541922
Synonyms: (6aS,6bR,9aS,10R)- 10- (1H- benzotriazol- 1- ylcarbonyl)- 8- (naphthalen- 2- yl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: O=C1N(c2ccc3c(c2)cccc3)C(=O)[C@H]2[C@@H]1[C@@H]1C=Cc3c(N1[C@H]2C(=O)n1nnc2c1cccc2)cccc3

STK541925
Synonyms: 3- (2,6- dichlorophenyl)- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1c1c(Cl)cccc1Cl

STK541926
Synonyms: (2Z)- 2- cyano- N- (4- fluorophenyl)- 2- [5- (4- methoxybenzyl)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]ethanamide
Smiles: N#C/C(=C\1/SC(C(=O)N1c1ccccc1)Cc1ccc(cc1)OC)/C(=O)Nc1ccc(cc1)F

STK541928
Synonyms: (3aR,6aS)- 3- (4- bromophenyl)- 5- (2- fluorophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: Brc1ccc(cc1)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1F

STK541930
Synonyms: 3- [(Z)- (3- butyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 2- [4- (2- methoxyphenyl)piperazin- 1- yl]- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2OC)/C1=O

STK541931
Synonyms: 5- (4- chlorophenyl)- 4- {4- [(2- methylnaphthalen- 1- yl)methyl]piperazin- 1- yl}thieno[2,3- d]pyrimidine
Smiles: Clc1ccc(cc1)c1csc2c1c(ncn2)N1CCN(CC1)Cc1c(C)ccc2c1cccc2

STK541932
Synonyms: diphenylmethyl(1'R,2'S,3R)- 2'- [(4- methoxyphenyl)carbonyl]- 2- oxo- 1,1',2,2'- tetrahydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinoline]- 1'- carboxylate
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@H](C(=O)OC(c2ccccc2)c2ccccc2)N2C([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1

STK541933
Synonyms: 2- [4- (2- methoxyphenyl)piperazin- 1- yl]- 9- methyl- 3- {(Z)- [4- oxo- 3- (propan- 2- yl)- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: COc1ccccc1N1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C(C)C

STK541934
Synonyms: 2- {[5- (3,4- dimethoxyphenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- 1H- indol- 3- ylmethylidene]acetohydrazide
Smiles: COc1cc(ccc1OC)c1nnc(n1CC)SCC(=O)N/N=C/c1c[nH]c2c1cccc2

STK541935
Synonyms: bis[5- methyl- 2- (propan- 2- yl)cyclohexyl]{(4- methoxyphenyl)[(1- phenylethyl)amino]methyl}phosphonate
Smiles: COc1ccc(cc1)C(P(=O)(OC1CC(C)CCC1C(C)C)OC1CC(C)CCC1C(C)C)NC(c1ccccc1)C

STK541936
Synonyms: 2- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 3- (2- phenylethyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: Brc1ccc(cc1)C(=O)CSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CCCC3

STK541937
Synonyms: (2E,6E)- 2,6- bis(1H- indol- 3- ylmethylidene)- 4- methylcyclohexanone
Smiles: CC1C/C(=C\c2c[nH]c3c2cccc3)/C(=O)/C(=C/c2c[nH]c3c2cccc3)/C1

STK541938
Synonyms: 5- (furan- 2- yl)- 8- methoxy- 2,2- dimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: COc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccco1

STK541939
Synonyms: diphenylmethyl(1'R,2'S,3R)- 2- oxo- 1'- (phenylcarbonyl)- 1,1',2,2'- tetrahydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinoline]- 2'- carboxylate
Smiles: O=C([C@@H]1N2c3ccccc3C=CC2[C@]2([C@@H]1C(=O)OC(c1ccccc1)c1ccccc1)C(=O)Nc1c2cccc1)c1ccccc1

STK541940
Synonyms: (4aR,8aS)- 1,4- bis[(4- methylbenzyl)oxy]octahydroquinoxaline- 2,3- dione
Smiles: O=C1N(OCc2ccc(cc2)C)[C@@H]2CCCC[C@@H]2N(C1=O)OCc1ccc(cc1)C

STK541941
Synonyms: 2- [4- (2- chlorobenzyl)piperazin- 1- yl]- N'- [(E)- (4- ethoxy- 3- methoxyphenyl)methylidene]acetohydrazide
Smiles: CCOc1ccc(cc1OC)/C=N/NC(=O)CN1CCN(CC1)Cc1ccccc1Cl

STK541943
Synonyms: 10- methyl- 8- phenyl- N- [3- (trifluoromethyl)phenyl]- 11- (3,4,5- trimethoxyphenyl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1c(OC)cc(cc1OC)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cccc(c1)C(F)(F)F)c1ccccc1

STK541944
Synonyms: 1- amino- N- (4- bromophenyl)- 8,8- dimethyl- 5- (morpholin- 4- yl)- 8,9- dihydro- 6H- pyrano[4,3- d]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: Brc1ccc(cc1)NC(=O)c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCOCC1

STK541945
Synonyms: 3- (hexylsulfanyl)- 11- (2- methylpropyl)- 7,8,9,10- tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3- c]isoquinoline
Smiles: CCCCCCSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)CC(C)C

STK541946
Synonyms: (1'R,2'S,3R)- 1'- acetyl- 7'- chloro- 2'- [(4- fluorophenyl)carbonyl]- 1',2'- dihydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1[C@H](C(=O)C)N2C([C@]31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)Cl

STK541949
Synonyms: N- (1,3- benzodioxol- 5- yl)- 11- (4- chlorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Clc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1ccc2c(c1)OCO2)c1ccccc1

STK541950
Synonyms: 3- (6,6- dimethylbicyclo[3.1.1]hept- 2- en- 2- yl)- 5- imino- 1,7- dimethyl- 2,6- dioxabicyclo[2.2.2]octane- 4,8,8- tricarbonitrile
Smiles: N#CC12C(=N)OC(OC1C1=CCC3CC1C3(C)C)(C(C2(C#N)C#N)C)C

STK541951
Synonyms: 5- [3- (3,4- dimethoxyphenyl)- 5- phenyl- 4,5- dihydro- 1H- pyrazol- 1- yl]- 5- oxopentanoicacid
Smiles: COc1ccc(cc1OC)C1=NN(C(C1)c1ccccc1)C(=O)CCCC(=O)O

STK541952
Synonyms: N- (4- ethylphenyl)- 10- methyl- 11- (3- nitrophenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)[N+](=O)[O-])c(nn1c1ccccc1)C

STK541953
Synonyms: 5- methyl- 2- (propan- 2- yl)cyclohexyl[(3,4- dimethoxyphenyl)(hydroxy)methyl][4- (dimethylamino)phenyl]phosphinate
Smiles: COc1ccc(cc1OC)C(P(=O)(c1ccc(cc1)N(C)C)OC1CC(C)CCC1C(C)C)O

STK541954
Synonyms: dipropan- 2- yl[(benzylamino)(2- fluorophenyl)methyl]phosphonate
Smiles: CC(OP(=O)(C(c1ccccc1F)NCc1ccccc1)OC(C)C)C

STK541955
Synonyms: 10- phenyl- 3- {[4- (propan- 2- yloxy)benzyl]sulfanyl}- 8,9- dihydro- 7H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: CC(Oc1ccc(cc1)CSc1nnc2n1cnc1c2sc2c1c1CCCc1c(n2)c1ccccc1)C

STK541956
Synonyms: N'- [(1Z)- 1- (4- bromophenyl)ethylidene]- 2- [4- (4- methylbenzyl)piperazin- 1- yl]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)C)N/N=C(\c1ccc(cc1)Br)/C

STK541957
Synonyms: 2- {[7- benzyl- 3- (3- methylphenyl)- 4- oxo- 3,4,5,6,7,8- hexahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- (3- methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCN(C3)Cc1ccccc1

STK541958
Synonyms: methyl5- chloro- 3- {[2- (2,6- dimethylmorpholin- 4- yl)propanoyl]amino}- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C(N1CC(C)OC(C1)C)C)cc(cc2)Cl

STK541960
Synonyms: 2- (4- methoxy- 3- nitrophenyl)imidazo[1,2- a]pyridine
Smiles: COc1ccc(cc1[N+](=O)[O-])c1nc2n(c1)cccc2

STK541962
Synonyms: 2- {[2- (2- hydroxyethoxy)ethyl]amino}- 9- methyl- 3- [(Z)- (4- oxo- 3- pentyl- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCCCCN1C(=S)S/C(=C\c2c(NCCOCCO)nc3n(c2=O)cccc3C)/C1=O

STK541967
Synonyms: methyl(1- {9- methyl- 4- oxo- 3- [(Z)- (4- oxo- 3- pentyl- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 4H- pyrido[1,2- a]pyrimidin- 2- yl}- 3- oxopiperazin- 2- yl)acetate
Smiles: CCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCNC(=O)C2CC(=O)OC)/C1=O

STK541968
Synonyms: 2- (butylsulfanyl)- 8- ethyl- 8- methyl- 3- (4- methylphenyl)- 3,6,8,9- tetrahydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 4- one
Smiles: CCCCSc1nc2nc3CC(C)(CC)OCc3cc2c(=O)n1c1ccc(cc1)C

STK541969
Synonyms: 1- (furan- 2- ylmethyl)- 4- hydroxy- N- (3- methoxyphenyl)- 2- oxo- 1,2,5,6,7,8- hexahydroquinoline- 3- carboxamide
Smiles: COc1cccc(c1)NC(=O)c1c(O)c2CCCCc2n(c1=O)Cc1ccco1

STK541970
Synonyms: 10,10- dimethyl- 2- [(2- methylphenoxy)methyl]- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1ccccc1OCc1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

STK541971
Synonyms: 2'- (4- methylphenyl)- 1- (propan- 2- yl)- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: Cc1ccc(cc1)C1=NN2C(C1)c1ccccc1OC12CCN(CC1)C(C)C

STK541973
Synonyms: 5- nitro- 4,6- di(piperidin- 1- yl)pyrimidine
Smiles: [O-][N+](=O)c1c(ncnc1N1CCCCC1)N1CCCCC1

STK541974
Synonyms: (3aS,6aS)- 3- (4- bromophenyl)- 5- (4- fluorophenyl)- 1- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C(=NN2c1ccccc1)c1ccc(cc1)Br

STK541975
Synonyms: 7- (4- fluorophenyl)- 9- phenyl- 5,7- dihydro- 6H- benzo[h][1,3]thiazolo[2,3- b]quinazoline
Smiles: Fc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccccc1)c1c(CC2)cccc1

STK541976
Synonyms: 4,5- dimethyl- 2- {[3- (4- methylpiperazin- 1- yl)quinoxalin- 2- yl]amino}thiophene- 3- carbonitrile
Smiles: N#Cc1c(Nc2nc3ccccc3nc2N2CCN(CC2)C)sc(c1C)C

STK541977
Synonyms: (3aS,6aS)- 5- (naphthalen- 1- yl)- 3- (4- nitrophenyl)- 1- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: O=C1[C@@H]2C(=NN([C@@H]2C(=O)N1c1cccc2c1cccc2)c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

STK541978
Synonyms: N- (4- {[11- (3- bromophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- yl]amino}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccc(c2)Br)c(nn1c1ccccc1)C

STK541980
Synonyms: methylN- {[3- (pentafluorophenoxy)phenyl]carbamoyl}- L- tryptophanate
Smiles: COC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)Nc1cccc(c1)Oc1c(F)c(F)c(c(c1F)F)F

STK541981
Synonyms: (3aR,6aS)- 5- (3,5- dichlorophenyl)- 3- (4- nitrophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: O=C1[C@H]2[C@@H](C(=O)N1c1cc(Cl)cc(c1)Cl)ON=C2c1ccc(cc1)[N+](=O)[O-]

STK541982
Synonyms: 1- (4- propoxyphenyl)- 3- (propylamino)pyrrolidine- 2,5- dione
Smiles: CCCNC1CC(=O)N(C1=O)c1ccc(cc1)OCCC

STK541983
Synonyms: (3aR,6aS)- 3- (4- bromophenyl)- 5- phenyl- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: Brc1ccc(cc1)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1

STK541987
Synonyms: (3aR,6aS)- 3- (4- bromophenyl)- 5- (2- chlorophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: Brc1ccc(cc1)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1Cl

STK541989
Synonyms: 1- methyl- 4- (2- phenylethyl)- 7- (propan- 2- yl)- 6,9- dihydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: CC(C1OCc2c(C1)c1c(=O)n(CCc3ccccc3)c3n(c1s2)c(C)nn3)C

STK541990
Synonyms: 11- (4- chlorophenyl)- 10- methyl- 6- (morpholin- 4- yl)- 8- (4- nitrophenyl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxaline
Smiles: Clc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2N1CCOCC1)c1ccc(cc1)[N+](=O)[O-]

STK541991
Synonyms: 6- (2- cycloheptylidenehydrazinyl)[1,2,4]triazolo[4,3- b]pyridazine
Smiles: C1CCCC(=NNc2ccc3n(n2)cnn3)CC1

STK541992
Synonyms: tert- butyl(8S,8aR)- 6- amino- 5,7,7- tricyano- 8- (3- methoxy- 4- propoxyphenyl)- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCCOc1ccc(cc1OC)[C@@H]1[C@H]2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(=O)OC(C)(C)C

STK541993
Synonyms: 2- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 6- iodo- 3- (2- methylphenyl)quinazolin- 4(3H)- one
Smiles: Brc1ccc(cc1)C(=O)CSc1nc2ccc(cc2c(=O)n1c1ccccc1C)I

STK541994
Synonyms: 3- (dipentylamino)- 1- (4- ethylphenyl)pyrrolidine- 2,5- dione
Smiles: CCCCCN(C1CC(=O)N(C1=O)c1ccc(cc1)CC)CCCCC

STK541995
Synonyms: 2,5- dichloro- N- [3- (phenylamino)quinoxalin- 2- yl]benzenesulfonamide
Smiles: Clc1ccc(c(c1)S(=O)(=O)Nc1nc2ccccc2nc1Nc1ccccc1)Cl

STK541996
Synonyms: N,N- dibutyl- 2- {[6,6- dimethyl- 3- (3- methylphenyl)- 4- oxo- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)(C)C)CCCC

STK541997
Synonyms: 1- benzyl- 9'- bromo- 2'- (5- bromothiophen- 2- yl)- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: Brc1ccc2c(c1)C1CC(=NN1C1(O2)CCN(CC1)Cc1ccccc1)c1ccc(s1)Br

STK541998
Synonyms: 2- (piperidin- 1- yl)ethyl3- methyl- 1- benzofuran- 2- carboxylate
Smiles: O=C(c1oc2c(c1C)cccc2)OCCN1CCCCC1

STK542000
Synonyms: 5- (furan- 2- yl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 3- carboxylicacid
Smiles: OC(=O)c1cnn2c1nc(cc2C(F)(F)F)c1ccco1

STK542001
Synonyms: 2- {[2- (4- bromophenyl)- 2- oxoethyl]sulfanyl}- 3- (2- phenylethyl)- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Brc1ccc(cc1)C(=O)CSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CC(OC3)C(C)C

STK542002
Synonyms: N- [4- (benzyloxy)phenyl]- 3- [4- (2- hydroxyethyl)piperazin- 1- yl]propanamide
Smiles: OCCN1CCN(CC1)CCC(=O)Nc1ccc(cc1)OCc1ccccc1

STK542003
Synonyms: 2- [(E)- (naphthalen- 1- ylimino)methyl]- 1- benzothiophene- 3- ol
Smiles: Oc1c(/C=N/c2cccc3c2cccc3)sc2c1cccc2

STK542004
Synonyms: 2,5- dimethyl- N'- [(E)- (2,4,5- trimethoxyphenyl)methylidene]furan- 3- carbohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)c1cc(oc1C)C)OC

STK542005
Synonyms: N- {1- benzyl- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(NS(=O)(=O)c2ccccc2)n(c2c1nc1ccccc1n2)Cc1ccccc1

STK542006
Synonyms: 2- {[2,2- dimethyl- 5- (morpholin- 4- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- yl]sulfanyl}- N- (pyridin- 2- yl)acetamide
Smiles: O=C(Nc1ccccn1)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK542007
Synonyms: pentyl{[5- (propan- 2- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl]sulfanyl}acetate
Smiles: CCCCCOC(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)C(C)C

STK542008
Synonyms: N- (3,5- dichlorophenyl)- 11- (4- ethoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cc(Cl)cc(c1)Cl)nc1c2cccc1

STK542009
Synonyms: methyl(1S,2R,3R)- 1- cyano- 2- phenyl- 3- (phenylcarbonyl)- 1,2,3,10b- tetrahydropyrrolo[2,1- a]isoquinoline- 1- carboxylate
Smiles: COC(=O)[C@@]1(C#N)[C@@H](c2ccccc2)[C@@H](N2C1c1ccccc1C=C2)C(=O)c1ccccc1

STK542011
Synonyms: (1,3- dioxo- 1,3- dihydro- 2H- isoindol- 2- yl)methylN- [(benzyloxy)carbonyl]isoleucinate
Smiles: CCC(C(C(=O)OCN1C(=O)c2c(C1=O)cccc2)NC(=O)OCc1ccccc1)C

STK542012
Synonyms: 2- cyano- 2- [3- (morpholin- 4- yl)quinoxalin- 2- yl]- N- pentylacetamide
Smiles: CCCCCNC(=O)C(c1nc2ccccc2nc1N1CCOCC1)C#N

STK542013
Synonyms: diphenylmethyl(6aR,6bS,9aR,10S)- 8- (4- fluorophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxylate
Smiles: Fc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)OC(c1ccccc1)c1ccccc1

STK542014
Synonyms: 2- [(4- amino- 6,6- dimethyl- 5,8- dihydro- 6H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- (2- methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc(N)c2c(n1)sc1c2CC(SC1)(C)C

STK542015
Synonyms: N- (2- methoxyphenyl)- 2- [(4- oxo- 3- phenyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: COc1ccccc1NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCCC3

STK542016
Synonyms: 11- (4- fluorophenyl)- N- (4- methoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)F)c(nn1c1ccccc1)C

STK542018
Synonyms: N- (4- butylphenyl)- 10- methyl- 8- phenyl- 11- (thiophen- 2- yl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCCCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cccs2)c(nn1c1ccccc1)C

STK542019
Synonyms: 2- {[6,6- dimethyl- 4- oxo- 3- (2- phenylethyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- phenylpropanamide
Smiles: CC(C(=O)Nc1ccccc1)Sc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CC(OC3)(C)C

STK542022
Synonyms: N- (3- methoxyphenyl)- 2- [(5,10,10- trimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc2n1c(C)nc1c2c2CC(C)(C)OCc2s1

STK542023
Synonyms: N- [(1- benzyl- 1H- benzimidazol- 2- yl)methyl]- 2- methylbenzamide
Smiles: O=C(c1ccccc1C)NCc1nc2c(n1Cc1ccccc1)cccc2

STK542025
Synonyms: 2- benzyl- 3- (2,5- dibromophenyl)quinazolin- 4(3H)- one
Smiles: Brc1ccc(c(c1)n1c(Cc2ccccc2)nc2c(c1=O)cccc2)Br

STK542026
Synonyms: N- (4- bromophenyl)- 2- {[4- oxo- 3- (2- phenylethyl)- 3,4,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CCCC3

STK542027
Synonyms: methyl3,3,3- trifluoro- N- (furan- 2- ylcarbonyl)- 2- [2- (4- nitrophenyl)hydrazinyl]alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccco1)NNc1ccc(cc1)[N+](=O)[O-]

STK542028
Synonyms: N- (4- bromophenyl)- 2- {[5- (propan- 2- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)C(C)C

STK542029
Synonyms: (3aR,6aS)- 3- (4- bromophenyl)- 5- [3- (trifluoromethyl)phenyl]- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: Brc1ccc(cc1)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F

STK542030
Synonyms: (2- fluorophenyl)[5- (furan- 2- yl)- 3- (4- methylphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]methanone
Smiles: Cc1ccc(cc1)C1=NN(C(C1)c1ccco1)C(=O)c1ccccc1F

STK542031
Synonyms: 2- (4- benzylpiperazin- 1- yl)- N'- [(E)- (2- methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)CN1CCN(CC1)Cc1ccccc1

STK542032
Synonyms: (2E)- N- {1- [1- (2,6- dichlorobenzyl)- 1H- benzimidazol- 2- yl]ethyl}- 3- phenylprop- 2- enamide
Smiles: O=C(NC(c1nc2c(n1Cc1c(Cl)cccc1Cl)cccc2)C)/C=C/c1ccccc1

STK542033
Synonyms: 4- {2- [(4- chlorophenyl)amino]- 2- oxoethyl}- 5- (4- methylphenyl)- N- phenylthiophene- 2- carboxamide
Smiles: O=C(Cc1cc(sc1c1ccc(cc1)C)C(=O)Nc1ccccc1)Nc1ccc(cc1)Cl

STK542034
Synonyms: N- phenyl- 2- [(3,6,6- trimethyl- 4- oxo- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccccc1)CSc1nc2sc3c(c2c(=O)n1C)CC(OC3)(C)C

STK542035
Synonyms: (9E)- 9- (4- bromobenzylidene)- 5- (4- bromophenyl)- 3- (4- methylphenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: Brc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)C)/C(=C/c1ccc(cc1)Br)/CCC2

STK542037
Synonyms: (4E)- 4- (1- hydroxyethylidene)- 1- (3- hydroxypropyl)- 5- (4- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: OCCCN1C(=O)C(=O)/C(=C(/O)\C)/C1c1ccc(cc1)[N+](=O)[O-]

STK542038
Synonyms: 2- amino- N- cyclopropyl- 1- (4- ethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCOc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)NC1CC1

STK542039
Synonyms: N- (2- methoxyphenyl)- 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccccc1NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3

STK542041
Synonyms: N- (3,5- dichlorophenyl)- 11- (2- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Clc1cc(cc(c1)Cl)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccccc1F)C)c1ccccc1

STK542042
Synonyms: ethyl7- nitro- 2- oxo- 2H- chromene- 3- carboxylate
Smiles: CCOC(=O)c1cc2ccc(cc2oc1=O)[N+](=O)[O-]

STK542043
Synonyms: 2- [(2- benzyl- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl)sulfanyl]- N- methyl- N- phenylacetamide
Smiles: CN(c1ccccc1)C(=O)CSc1nc(Cc2ccccc2)nc2c1c1CC(C)(C)OCc1s2

STK542044
Synonyms: 2'- (2,5- dimethylphenyl)- 7'- methoxy- 1- methyl- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: COc1cccc2c1OC1(CCN(CC1)C)N1C2CC(=N1)c1cc(C)ccc1C

STK542045
Synonyms: methyl5- bromo- 3- [(cyclohexylcarbamoyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)NC1CCCCC1)cc(cc2)Br

STK542046
Synonyms: 1- (benzyloxy)- 3- (naphthalen- 1- yl)quinoxalin- 2(1H)- one4- oxide
Smiles: [O-][n+]1c(c2cccc3c2cccc3)c(=O)n(c2c1cccc2)OCc1ccccc1

STK542047
Synonyms: 4- chloro- N- {3- [(3,4,5- trimethoxyphenyl)amino]quinoxalin- 2- yl}benzenesulfonamide
Smiles: COc1c(OC)cc(cc1OC)Nc1nc2ccccc2nc1NS(=O)(=O)c1ccc(cc1)Cl

STK542048
Synonyms: 2,5- dichloro- N- {3- [(3,4- dichlorophenyl)amino]quinoxalin- 2- yl}benzenesulfonamide
Smiles: Clc1ccc(c(c1)S(=O)(=O)Nc1nc2ccccc2nc1Nc1ccc(c(c1)Cl)Cl)Cl

STK542050
Synonyms: N- (2,5- dimethoxyphenyl)- 10- methyl- 8- phenyl- 11- (thiophen- 2- yl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccc(c(c1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cccs1)C)c1ccccc1)OC

STK542051
Synonyms: (8E)- 2- amino- 8- (4- fluorobenzylidene)- 4- (4- fluorophenyl)- 6- propyl- 5,6,7,8- tetrahydro- 4H- pyrano[3,2- c]pyridine- 3- carbonitrile
Smiles: CCCN1C/C(=C\c2ccc(cc2)F)/C2=C(C1)C(c1ccc(cc1)F)C(=C(O2)N)C#N

STK542052
Synonyms: 3- (3,4- dichlorophenyl)- 2- {[2- (4- fluorophenyl)- 2- oxoethyl]sulfanyl}- 5,6- dimethylthieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: Fc1ccc(cc1)C(=O)CSc1nc2sc(c(c2c(=O)n1c1ccc(c(c1)Cl)Cl)C)C

STK542053
Synonyms: 9- methyl- 3- {(Z)- [3- (2- methylpropyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (thiomorpholin- 4- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CC(CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCSCC2)/C1=O)C

STK542054
Synonyms: ethyl5- chloro- 3- [(cyclohexylcarbamothioyl)amino]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=S)NC1CCCCC1)cc(cc2)Cl

STK542055
Synonyms: methyl(1R,2R,3S)- 2- (4- bromophenyl)- 3- cyano- 1- (phenylcarbamoyl)- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinoline- 3- carboxylate
Smiles: COC(=O)[C@@]1(C#N)[C@@H](c2ccc(cc2)Br)[C@@H](N2C1C=Cc1c2cccc1)C(=O)Nc1ccccc1

STK542058
Synonyms: ethyl5- methoxy- 3- [(morpholin- 4- ylcarbonyl)amino]- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)N1CCOCC1)cc(cc2)OC

STK542060
Synonyms: N- {[2- (4- sulfamoylphenyl)ethyl]carbamothioyl}furan- 2- carboxamide
Smiles: S=C(NC(=O)c1ccco1)NCCc1ccc(cc1)S(=O)(=O)N

STK542061
Synonyms: 3- ethyl- 6- iodo- 2- [(2- phenylethyl)sulfanyl]quinazolin- 4(3H)- one
Smiles: CCn1c(SCCc2ccccc2)nc2c(c1=O)cc(cc2)I

STK542063
Synonyms: [(benzylamino)(phenyl)methyl](hydroxymethyl)phosphinicacid
Smiles: OCP(=O)(C(c1ccccc1)NCc1ccccc1)O

STK542066
Synonyms: 7- [(1,3- benzodioxol- 5- ylmethyl)sulfanyl]- 4- phenyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: c1ccc(cc1)c1nc2sc3c(c2c2c1CCC2)ncnc3SCc1ccc2c(c1)OCO2

STK542067
Synonyms: N- (1,3- benzodioxol- 5- yl)- 10- methyl- 8- phenyl- 11- (thiophen- 2- yl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1nn(c2c1C(c1cccs1)n1c(=N2)c(Nc2ccc3c(c2)OCO3)nc2c1cccc2)c1ccccc1

STK542068
Synonyms: 2- ethyl- 3- methyl- 1- [4- (4- methylpyridin- 2- yl)piperazin- 1- yl]pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(c1N1CCN(CC1)c1nccc(c1)C)c1ccccc1n2

STK542069
Synonyms: N'- {(E)- [4- (benzyloxy)- 3- methoxyphenyl]methylidene}- 2- [4- (2- chlorobenzyl)piperazin- 1- yl]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CN2CCN(CC2)Cc2ccccc2Cl)ccc1OCc1ccccc1

STK542072
Synonyms: 7- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 4- phenyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CC(=C)CSc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK542075
Synonyms: methyl3- {[(2- methoxyphenyl)carbamoyl]amino}- 5- methyl- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)Nc1ccccc1OC)cc(cc2)C

STK542076
Synonyms: N- [(1E)- 3- (benzylamino)- 3- oxo- 1- phenylprop- 1- en- 2- yl]- 4- [(phenylcarbonyl)amino]benzamide
Smiles: O=C(c1ccc(cc1)NC(=O)c1ccccc1)N/C(=C/c1ccccc1)/C(=O)NCc1ccccc1

STK542077
Synonyms: 2- {3- [(3aS,6aS)- 5- (3- chlorophenyl)- 4,6- dioxo- 1,3a,4,5,6,6a- hexahydropyrrolo[3,4- c]pyrazol- 3- yl]- 3- oxopropyl}- 1H- isoindole- 1,3(2H)- dione
Smiles: Clc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)NN=C2C(=O)CCN1C(=O)c2c(C1=O)cccc2

STK542079
Synonyms: (3aS,6aS)- 5- (3- fluorophenyl)- 3- (4- methoxyphenyl)- 1- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: COc1ccc(cc1)C1=NN([C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)F)c1ccccc1

STK542082
Synonyms: methyl(2Z)- {(2Z)- 4- oxo- 2- [(2E)- (2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)hydrazinylidene]- 1,3- thiazolidin- 5- ylidene}ethanoate
Smiles: COC(=O)/C=C/1\S/C(=N\N=C/2\C(=O)Nc3c2cccc3)/NC1=O

STK542083
Synonyms: 2- hydrazinyl- 3- (2- phenylethyl)- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: NNc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CC(OC3)C(C)C

STK542084
Synonyms: dipropan- 2- yl[(3- nitrophenyl)(phenylamino)methyl]phosphonate
Smiles: CC(OP(=O)(C(c1cccc(c1)[N+](=O)[O-])Nc1ccccc1)OC(C)C)C

STK542085
Synonyms: (3aR,4S,9aR,9bS)- 4- [(4- bromophenyl)carbonyl]- 2- (2- methyl- 4- nitrophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Brc1ccc(cc1)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-])C(=O)c1ccccc1

STK542086
Synonyms: 2- {4- [(4- bromophenyl)sulfonyl]piperazin- 1- yl}- N'- [(E)- (4- nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C/c1ccc(cc1)[N+](=O)[O-]

STK542088
Synonyms: 11- benzyl- 3- (2- phenylethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: O=c1n(CCc2ccccc2)cnc2c1c1nc3ccccc3nc1n2Cc1ccccc1

STK542089
Synonyms: 8- benzyl- 7- (4- chlorophenyl)- 1,3- dimethyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: Clc1ccc(cc1)c1cn2c(n1Cc1ccccc1)nc1c2c(=O)n(C)c(=O)n1C

STK542090
Synonyms: (2E,5Z)- 2- {[5- (3- nitrobenzyl)- 1,3- thiazol- 2- yl]imino}- 5- {[5- (4- nitrophenyl)furan- 2- yl]methylidene}- 3- phenyl- 1,3- thiazolidin- 4- one
Smiles: O=C1/C(=C/c2ccc(o2)c2ccc(cc2)[N+](=O)[O-])/S/C(=N/c2ncc(s2)Cc2cccc(c2)[N+](=O)[O-])/N1c1ccccc1

STK542091
Synonyms: ethyl3- [(cyclohexylcarbamothioyl)amino]- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=S)NC1CCCCC1)cc(cc2)OC

STK542092
Synonyms: 4- methyl- N- {3- [(4- methylphenyl)sulfonyl]- 1- (2- phenylethyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1n(CCc2ccccc2)c2c(c1S(=O)(=O)c1ccc(cc1)C)nc1c(n2)cccc1

STK542093
Synonyms: N- ethyl- 2- (pyrazin- 2- ylcarbonyl)hydrazinecarbothioamide
Smiles: CCNC(=S)NNC(=O)c1cnccn1

STK542094
Synonyms: bis[5- methyl- 2- (propan- 2- yl)cyclohexyl][(2,4- dichlorophenyl)(hydroxy)methyl]phosphonate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccc(cc1Cl)Cl)O)OC1CC(C)CCC1C(C)C)C(C)C

STK542095
Synonyms: N'- [(E)- (3- bromophenyl)methylidene]- 2- {[5- (3,4- dimethoxyphenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: COc1cc(ccc1OC)c1nnc(n1CC)SCC(=O)N/N=C/c1cccc(c1)Br

STK542096
Synonyms: 2- [4- (2- chlorobenzyl)piperazin- 1- yl]- N'- [(E)- (2,4- dimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(OC)ccc1/C=N/NC(=O)CN1CCN(CC1)Cc1ccccc1Cl

STK542097
Synonyms: ethyl4- {[({5- [5- (1,3- dioxo- 1H- benzo[de]isoquinolin- 2(3H)- yl)pentyl]- 1,3,4- oxadiazol- 2- yl}sulfanyl)acetyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(o1)CCCCCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK542099
Synonyms: N- benzyl- 2- {[3- (3- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)n1c(SCC(=O)NCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK542100
Synonyms: (6aR,6bS,9aR,10S)- 10- [(4- chlorophenyl)carbonyl]- 8- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Clc1ccc(cc1)C(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1c1ccccc1C=C2)c1ccc2c(c1)OCCO2

STK542101
Synonyms: 6- methyl- 5- [4- (2- methylpropoxy)benzyl]- 2- sulfanylpyrimidin- 4- ol
Smiles: CC(COc1ccc(cc1)Cc1c(C)nc(nc1O)S)C

STK542103
Synonyms: 2- {4- [(4- bromophenyl)sulfonyl]piperazin- 1- yl}- N'- [(E)- (5- methylthiophen- 2- yl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C/c1ccc(s1)C

STK542104
Synonyms: N- {3- [(4- methylphenyl)sulfonyl]- 1- (prop- 2- en- 1- yl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}- 4- nitrobenzenesulfonamide
Smiles: C=CCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)[N+](=O)[O-])S(=O)(=O)c1ccc(cc1)C

STK542105
Synonyms: 1- (3,4- dichlorophenyl)- 2- {[(4- nitrophenyl)carbonyl]amino}- N- (prop- 2- en- 1- yl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: C=CCNC(=O)c1c(NC(=O)c2ccc(cc2)[N+](=O)[O-])n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)Cl

STK542106
Synonyms: N- (3- methylphenyl)- 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3

STK542107
Synonyms: (2E)- 2- cyano- 3- [5- (2- methylcyclopropyl)furan- 2- yl]- N- (naphthalen- 1- yl)prop- 2- enamide
Smiles: N#C/C(=C\c1ccc(o1)C1CC1C)/C(=O)Nc1cccc2c1cccc2

STK542108
Synonyms: N- {(1E)- 3- [(furan- 2- ylmethyl)amino]- 3- oxo- 1- phenylprop- 1- en- 2- yl}- 4- [(phenylcarbonyl)amino]benzamide
Smiles: O=C(/C(=C\c1ccccc1)/NC(=O)c1ccc(cc1)NC(=O)c1ccccc1)NCc1ccco1

STK542109
Synonyms: (3aS,6aS)- 5- (4- bromophenyl)- 3- (4- nitrophenyl)- 1- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: Brc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)N(N=C2c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK542112
Synonyms: 8,8- dimethyl- 3- (4- methylphenyl)- 2- (propylsulfanyl)- 3,6,8,9- tetrahydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 4- one
Smiles: CCCSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1ccc(cc1)C

STK542113
Synonyms: (3aR,6aS)- 5- (naphthalen- 2- yl)- 3- (4- nitrophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: O=C1[C@H]2ON=C([C@H]2C(=O)N1c1ccc2c(c1)cccc2)c1ccc(cc1)[N+](=O)[O-]

STK542115
Synonyms: [(1S,2R,3S)- 1- nitro- 2- phenyl- 1,2,3,10b- tetrahydropyrrolo[2,1- a]phthalazin- 3- yl](phenyl)methanone
Smiles: O=C([C@H]1N2N=Cc3c(C2[C@H]([C@@H]1c1ccccc1)[N+](=O)[O-])cccc3)c1ccccc1

STK542116
Synonyms: 8- ethyl- 2- {[2- (4- fluorophenyl)- 2- oxoethyl]sulfanyl}- 8- methyl- 3- (4- methylphenyl)- 3,6,8,9- tetrahydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 4- one
Smiles: CCC1(C)OCc2c(C1)nc1c(c2)c(=O)n(c(n1)SCC(=O)c1ccc(cc1)F)c1ccc(cc1)C

STK542117
Synonyms: 2- [4- (4- chlorobenzyl)piperazin- 1- yl]- N'- {(E)- [4- (methylsulfanyl)phenyl]methylidene}acetohydrazide
Smiles: CSc1ccc(cc1)/C=N/NC(=O)CN1CCN(CC1)Cc1ccc(cc1)Cl

STK542118
Synonyms: 6- iodo- 2- [(2- oxo- 2- phenylethyl)sulfanyl]- 3- (prop- 2- en- 1- yl)quinazolin- 4(3H)- one
Smiles: C=CCn1c(SCC(=O)c2ccccc2)nc2c(c1=O)cc(cc2)I

STK542119
Synonyms: 8- fluoro- N- (2- methoxybenzyl)- 5H- pyrimido[5,4- b]indol- 4- amine
Smiles: COc1ccccc1CNc1ncnc2c1[nH]c1c2cc(cc1)F

STK542120
Synonyms: methyl2- [(8S,8aR,11aS,11bS)- 9,11- dioxo- 8- (phenylcarbonyl)- 8a,9,11a,11b- tetrahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinolin- 10(11H)- yl]benzoate
Smiles: COC(=O)c1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccccc2)C=Cc2c1cccc2

STK542121
Synonyms: 1- phenyl- 2- [(5,10,10- trimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]ethanone
Smiles: O=C(c1ccccc1)CSc1nnc2n1c(C)nc1c2c2CC(C)(C)OCc2s1

STK542122
Synonyms: 4- (2,3- dichlorophenyl)- 2- (3- nitrophenyl)- 5- phenyl- 1H- imidazole
Smiles: Clc1c(Cl)cccc1c1nc([nH]c1c1ccccc1)c1cccc(c1)[N+](=O)[O-]

STK542123
Synonyms: 2- [4- (2- chlorobenzyl)piperazin- 1- yl]- N'- [(E)- (4- ethoxyphenyl)methylidene]acetohydrazide
Smiles: CCOc1ccc(cc1)/C=N/NC(=O)CN1CCN(CC1)Cc1ccccc1Cl

STK542124
Synonyms: N- (3- bromophenyl)- 4- hydroxy- 1- (2- methylpropyl)- 2- oxo- 1,2,5,6,7,8- hexahydroquinoline- 3- carboxamide
Smiles: CC(Cn1c2CCCCc2c(c(c1=O)C(=O)Nc1cccc(c1)Br)O)C

STK542126
Synonyms: 7- {4- [(1,3- benzodioxol- 5- ylcarbonyl)carbamothioyl]piperazin- 1- yl}- 1- ethyl- 6- fluoro- 4- oxo- 1,4- dihydro- 1,8- naphthyridine- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1nc(N1CCN(CC1)C(=S)NC(=O)c1ccc3c(c1)OCO3)c(c2)F

STK542127
Synonyms: 2- {[3- cyano- 4- (2,3- dichlorophenyl)- 5- oxo- 1,4,5,6,7,8- hexahydroquinolin- 2- yl]sulfanyl}- N- (4- methylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C)NC2=C(C1c1cccc(c1Cl)Cl)C(=O)CCC2

STK542128
Synonyms: 2- {[2,2- dimethyl- 5- (morpholin- 4- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- yl]sulfanyl}- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK542129
Synonyms: 2- [4- (2- chlorobenzyl)piperazin- 1- yl]- N'- [(1Z)- 1- (naphthalen- 2- yl)ethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccccc1Cl)N/N=C(\c1ccc2c(c1)cccc2)/C

STK542130
Synonyms: 3- [(Z)- (3- cyclopentyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 2- {[2- (2- hydroxyethoxy)ethyl]amino}- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: OCCOCCNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCCC1

STK542131
Synonyms: ethyl2- [(3- {[(4- chloro- 3- nitrophenyl)sulfonyl]amino}quinoxalin- 2- yl)amino]- 4,5- dimethylthiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccc(c(c2)[N+](=O)[O-])Cl)sc(c1C)C

STK542133
Synonyms: 1- benzyl- 6- chloro- 4- (dimethylamino)- 2,3- dihydro- 1H- pyrrolo[3,2- c]pyridine- 7- carbonitrile
Smiles: N#Cc1c(Cl)nc(c2c1N(CC2)Cc1ccccc1)N(C)C

STK542134
Synonyms: 2- {[5- (3,4- dimethoxyphenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (4- ethoxyphenyl)methylidene]acetohydrazide
Smiles: CCOc1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1CC)c1ccc(c(c1)OC)OC

STK542135
Synonyms: 1- (3,4- dimethylphenyl)- 2- (4- nitrophenyl)- 1H- imidazo[4,5- b]quinoxaline
Smiles: [O-][N+](=O)c1ccc(cc1)c1nc2c(n1c1ccc(c(c1)C)C)nc1c(n2)cccc1

STK542136
Synonyms: (8S,8aR,11aS,11bS)- 10- (2- fluorophenyl)- 8- (phenylcarbonyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]phthalazine- 9,11(8aH,10H)- dione
Smiles: O=C([C@H]1N2N=Cc3c([C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1F)cccc3)c1ccccc1

STK542137
Synonyms: (3aR,6aS)- 3- (4- nitrophenyl)- 5- [3- (trifluoromethyl)phenyl]- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: O=C1N(c2cccc(c2)C(F)(F)F)C(=O)[C@@H]2[C@H]1C(=NO2)c1ccc(cc1)[N+](=O)[O-]

STK542138
Synonyms: 4- fluoro- N- [(2Z,3E)- 2- (1- hydroxyethylidene)- 6,6- dimethylbicyclo[3.1.0]hex- 3- ylidene]benzamide
Smiles: Fc1ccc(cc1)C(=O)/N=C/1\CC2C(\C1=C(\O)/C)C2(C)C

STK542139
Synonyms: N- (2- methoxyphenyl)- 2- [(4- phenyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl)sulfanyl]acetamide
Smiles: COc1ccccc1NC(=O)CSc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK542140
Synonyms: methyl4- [(carbamimidoylsulfanyl)methyl]- 5- ethylfuran- 2- carboxylate
Smiles: COC(=O)c1cc(c(o1)CC)CSC(=N)N

STK542141
Synonyms: methyl3- {[(4- chlorophenyl)carbamoyl]amino}- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)Nc1ccc(cc1)Cl)cc(cc2)F

STK542142
Synonyms: 2,2- dimethyl- 2'- (4- methylphenyl)- 1',2,3,5,6,10b'- hexahydrospiro[pyran- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: Cc1ccc(cc1)C1=NN2C(C1)c1ccccc1OC12CCOC(C1)(C)C

STK542143
Synonyms: 2- {[8,8- dimethyl- 3- (3- methylphenyl)- 4- oxo- 3,6,8,9- tetrahydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- (4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1cccc(c1)C

STK542145
Synonyms: (4E)- 5- (2,3- dimethoxyphenyl)- 4- [hydroxy(4- methoxyphenyl)methylidene]- 1- [2- (morpholin- 4- yl)ethyl]pyrrolidine- 2,3- dione
Smiles: COc1c(OC)cccc1C1N(CCN2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC)/O

STK542146
Synonyms: N,N- diphenyl- 2- [(10- phenyl- 8,9- dihydro- 7H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetamide
Smiles: O=C(N(c1ccccc1)c1ccccc1)CSc1nnc2n1cnc1c2sc2c1c1CCCc1c(n2)c1ccccc1

STK542147
Synonyms: 2- benzyl- 3- (4- bromophenyl)quinazolin- 4(3H)- one
Smiles: Brc1ccc(cc1)n1c(Cc2ccccc2)nc2c(c1=O)cccc2

STK542148
Synonyms: 3- (2,5- dibromophenyl)- 2- [(E)- 2- (4- hydroxyphenyl)ethenyl]quinazolin- 4(3H)- one
Smiles: Oc1ccc(cc1)/C=C/c1nc2ccccc2c(=O)n1c1cc(Br)ccc1Br

STK542149
Synonyms: 2- chloro- N- (4- methyl- 3,6- dihydro- 2H- pyran- 3- yl)- N- (4- methylphenyl)acetamide
Smiles: ClCC(=O)N(C1COCC=C1C)c1ccc(cc1)C

STK542151
Synonyms: 2- [6- (morpholin- 4- yl)- 7- nitro- 2,1,3- benzoxadiazol- 4- yl]- 1,2,3,4- tetrahydroisoquinoline
Smiles: [O-][N+](=O)c1c(cc(c2c1non2)N1CCc2c(C1)cccc2)N1CCOCC1

STK542154
Synonyms: 2- [(4- methoxybenzyl)sulfanyl]- 3,6,6- trimethyl- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: COc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1C)CC(OC3)(C)C

STK542155
Synonyms: 3- {[(E)- (4- chlorophenyl)methylidene]amino}- 2- [(2- methylphenoxy)methyl]quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)/C=N/n1c(COc2ccccc2C)nc2c(c1=O)cccc2

STK542158
Synonyms: methyldifluoro[(2- phenyl- 1H- indol- 3- yl)sulfanyl]acetate
Smiles: COC(=O)C(Sc1c([nH]c2c1cccc2)c1ccccc1)(F)F

STK542159
Synonyms: 5- (4- bromophenyl)- 3- chloro- N- (3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: N#Cc1c(sc2c1CCCC2)NC(=O)c1nn2c(c1Cl)nc(cc2C(F)(F)F)c1ccc(cc1)Br

STK542160
Synonyms: 2,2- dimethyl- 5- (morpholin- 4- yl)- N- (4- phenylbutan- 2- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d][1,2,3]triazin- 8- amine
Smiles: CC(Nc1nnnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1)CCc1ccccc1

STK542162
Synonyms: (1'R,2'S,3R)- 2'- [(4- methoxyphenyl)carbonyl]- 1'- [(3- nitrophenyl)carbonyl]- 1',2'- dihydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@H](C(=O)c2cccc(c2)[N+](=O)[O-])N2C([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1

STK542163
Synonyms: 2- [(4- amino- 6,6- dimethyl- 5,8- dihydro- 6H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N- (furan- 2- ylmethyl)acetamide
Smiles: O=C(NCc1ccco1)CSc1nc(N)c2c(n1)sc1c2CC(SC1)(C)C

STK542164
Synonyms: N- [2- (morpholin- 4- yl)ethyl]- 4- phenyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- amine
Smiles: O1CCN(CC1)CCNc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK542165
Synonyms: N- (4- methoxyphenyl)- 2- {[5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK542167
Synonyms: 3- {(Z)- [3- (1,3- benzodioxol- 5- ylmethyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 9- methyl- 2- (propan- 2- ylamino)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CC(Nc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc2c(c1)OCO2)C

STK542168
Synonyms: 1- benzyl- N- cyclohexyl- 2- {[(4- methylphenyl)sulfonyl]amino}- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1c(C(=O)NC2CCCCC2)c2c(n1Cc1ccccc1)nc1c(n2)cccc1

STK542169
Synonyms: N- (3- methoxyphenyl)- 2- {[3- (4- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)OC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK542170
Synonyms: 2- {[4- oxo- 3- (prop- 2- en- 1- yl)- 3,4,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N,N- dipropylacetamide
Smiles: CCCN(C(=O)CSc1nc2sc3c(c2c(=O)n1CC=C)CCCC3)CCC

STK542171
Synonyms: 2- {[5- (4- tert- butylphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(1E,2E)- 3- (furan- 2- yl)- 2- methylprop- 2- en- 1- ylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C)N/N=C/C(=C/c1ccco1)/C

STK542172
Synonyms: 2- {4- [(4- bromophenyl)sulfonyl]piperazin- 1- yl}- N'- [(1E,2E)- 3- (2- nitrophenyl)prop- 2- en- 1- ylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C/C=C/c1ccccc1[N+](=O)[O-]

STK542174
Synonyms: ethylN- (5- chloro- 4- methyl- 1,3- benzothiazol- 2- yl)- 3,3,3- trifluoro- 2- (pentanoylamino)alaninate
Smiles: CCCCC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1sc2c(n1)c(C)c(cc2)Cl

STK542175
Synonyms: N- (4- methoxyphenyl)- 2- {[3- (3- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)OC)CCCCC3

STK542176
Synonyms: N'- [(E)- 1H- indol- 3- ylmethylidene]- 2- [4- (4- methylbenzyl)piperazin- 1- yl]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)C)N/N=C/c1c[nH]c2c1cccc2

STK542177
Synonyms: N'- [(E)- (2- bromophenyl)methylidene]- 2- [4- (4- methylbenzyl)piperazin- 1- yl]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)C)N/N=C/c1ccccc1Br

STK542179
Synonyms: 11- (5- bromofuran- 2- yl)- N- (4- butylphenyl)- 10- methyl- 8- phenyl- 7a,8,10a,11- tetrahydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCCCc1ccc(cc1)Nc1nc2ccccc2n2c1=NC1N(N=C(C1C2c1ccc(o1)Br)C)c1ccccc1

STK542180
Synonyms: N- (2,4- dichlorophenyl)- 2- {[5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK542181
Synonyms: 9- benzyl- 2- (4- methoxyphenyl)- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccc(cc1)c1nn2c(n1)c1c(nc2)sc2c1CCN(C2)Cc1ccccc1

STK542183
Synonyms: 2- {[7,7- dimethyl- 4- (3- methylphenyl)- 5- oxo- 4,5,6,9- tetrahydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}- N- phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CC(OC3)(C)C

STK542184
Synonyms: (3aR,6aS)- 3,5- bis(4- bromophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: Brc1ccc(cc1)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)Br

STK542185
Synonyms: ethyl(2E)- (diphenylphosphoryl)(2- phenylhydrazinylidene)ethanoate
Smiles: CCOC(=O)/C(=N\Nc1ccccc1)/P(=O)(c1ccccc1)c1ccccc1

STK542186
Synonyms: 1- [5- (furan- 2- yl)- 3- (4- methylphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 3- (piperidin- 1- yl)propan- 1- one
Smiles: Cc1ccc(cc1)C1=NN(C(C1)c1ccco1)C(=O)CCN1CCCCC1

STK542187
Synonyms: methylN- [(4- chlorophenyl)carbonyl]- 3,3,3- trifluoro- 2- [(5- methyl- 1,3- thiazol- 2- yl)amino]alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccc(cc1)Cl)Nc1ncc(s1)C

STK542192
Synonyms: (8S,8aR,11aS)- 10- (4- butoxyphenyl)- N- (4- chlorophenyl)- 9,11- dioxo- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 8- carboxamide
Smiles: CCCCOc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1C2c2ccccc2C=C1)C(=O)Nc1ccc(cc1)Cl

STK542194
Synonyms: N- (4- methylphenyl)- 2- [(10- phenyl- 8,9- dihydro- 7H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc2n1cnc1c2sc2c1c1CCCc1c(n2)c1ccccc1

STK542195
Synonyms: 2- amino- 1- (2,5- dimethoxyphenyl)- N- pentyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(OC)ccc1OC

STK542196
Synonyms: ethyl(8R,8aR)- 6- amino- 5,7,7- tricyano- 8- (thiophen- 3- yl)- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1ccsc1)C(C(=C2C#N)N)(C#N)C#N

STK542197
Synonyms: [4- (4- methylphenyl)piperazin- 1- yl][5- (2- nitrophenyl)furan- 2- yl]methanethione
Smiles: Cc1ccc(cc1)N1CCN(CC1)C(=S)c1ccc(o1)c1ccccc1[N+](=O)[O-]

STK542198
Synonyms: 2- {[6,6- dimethyl- 4- oxo- 3- (2- phenylethyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- methyl- N- phenylacetamide
Smiles: CN(c1ccccc1)C(=O)CSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CC(OC3)(C)C

STK542201
Synonyms: 5- (2- fluorophenyl)- 4- (naphthalen- 1- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccccc1c1n[nH]c(=S)n1c1cccc2c1cccc2

STK542202
Synonyms: 2- [(E)- 2- (5- bromo- 2- hydroxyphenyl)ethenyl]- 3- (2,5- dibromophenyl)quinazolin- 4(3H)- one
Smiles: Brc1ccc(c(c1)/C=C/c1nc2ccccc2c(=O)n1c1cc(Br)ccc1Br)O

STK542203
Synonyms: methyl(1S,2S,3S)- 1- acetyl- 2- (4- bromophenyl)- 3- cyano- 7- methoxy- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinoline- 3- carboxylate
Smiles: COC(=O)[C@@]1(C#N)[C@H](c2ccc(cc2)Br)[C@H](N2C1C=Cc1c2ccc(c1)OC)C(=O)C

STK542204
Synonyms: bis(2- methylpropyl)[(2,4- dimethoxyphenyl)(phenylamino)methyl]phosphonate
Smiles: COc1cc(OC)ccc1C(P(=O)(OCC(C)C)OCC(C)C)Nc1ccccc1

STK542205
Synonyms: (4E)- 5- (3,4- dimethoxyphenyl)- 4- [hydroxy(4- methoxyphenyl)methylidene]- 1- [2- (morpholin- 4- yl)ethyl]pyrrolidine- 2,3- dione
Smiles: COc1cc(ccc1OC)C1N(CCN2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC)/O

STK542207
Synonyms: 4- (4- bromophenyl)- 2- (2,3- dichlorophenyl)- 5- phenyl- 1H- imidazole
Smiles: Brc1ccc(cc1)c1nc([nH]c1c1ccccc1)c1cccc(c1Cl)Cl

STK542209
Synonyms: 2- (butan- 2- ylamino)- 3- [(Z)- {3- [2- (3,4- dimethoxyphenyl)ethyl]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene}methyl]- 9- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCC(Nc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCc1ccc(c(c1)OC)OC)C

STK542210
Synonyms: N- [1- benzyl- 3- (phenylsulfonyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl]- 4- methylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1n(Cc2ccccc2)c2c(c1S(=O)(=O)c1ccccc1)nc1c(n2)cccc1

STK542211
Synonyms: ethyl(3- oxo- 1- {4- oxo- 3- [(Z)- (4- oxo- 3- pentyl- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 4H- pyrido[1,2- a]pyrimidin- 2- yl}piperazin- 2- yl)acetate
Smiles: CCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCNC(=O)C2CC(=O)OCC)/C1=O

STK542212
Synonyms: 2- (furan- 2- yl)- 1- (4- methylphenyl)- 1H- imidazo[4,5- b]quinoxaline
Smiles: Cc1ccc(cc1)n1c(nc2c1nc1ccccc1n2)c1ccco1

STK542213
Synonyms: (4E)- 5- (4- bromophenyl)- 4- (1- hydroxyethylidene)- 1- phenylpyrrolidine- 2,3- dione
Smiles: Brc1ccc(cc1)C1/C(=C(\O)/C)/C(=O)C(=O)N1c1ccccc1

STK542217
Synonyms: 2- (hexylsulfanyl)- 3- (2- phenylethyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: CCCCCCSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CCCC3

STK542218
Synonyms: 2- [(E)- {[2- chloro- 5- (trifluoromethyl)phenyl]imino}methyl]- 1- benzothiophene- 3- ol
Smiles: Clc1ccc(cc1/N=C/c1sc2c(c1O)cccc2)C(F)(F)F

STK542219
Synonyms: 2- [4- (4- methylbenzyl)piperazin- 1- yl]- N'- [(1E)- 1- (naphthalen- 2- yl)ethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)C)N/N=C(/c1ccc2c(c1)cccc2)\C

STK542220
Synonyms: 3- butyl- 11- (4- methylphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)C

STK542221
Synonyms: 3- (2- methoxyphenyl)- 2- [(E)- 2- (3- methylphenyl)ethenyl]quinazolin- 4(3H)- one
Smiles: COc1ccccc1n1c(/C=C/c2cccc(c2)C)nc2c(c1=O)cccc2

STK542223
Synonyms: N- (4- butylphenyl)- 11- (2- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCCCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccccc1F)C)c1ccccc1

STK542224
Synonyms: N'- [(E)- (2,2- dichloro- 1- phenylcyclopropyl)methylidene]- 2- (naphthalen- 1- yl)acetohydrazide
Smiles: O=C(Cc1cccc2c1cccc2)N/N=C/C1(CC1(Cl)Cl)c1ccccc1

STK542225
Synonyms: 3- benzyl- 6- iodo- 2- [(Z)- (1- methyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)methyl]quinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C\1/c2ccccc2N(C1=O)C)Cc1ccccc1

STK542226
Synonyms: (4E)- 5- (3- ethoxy- 4- hydroxyphenyl)- 4- [hydroxy(4- methoxy- 3- methylphenyl)methylidene]- 1- (3- methoxypropyl)pyrrolidine- 2,3- dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/O)/C1c1ccc(c(c1)OCC)O

STK542227
Synonyms: methyl6- oxo- 6H- anthra[9,1- bc]furan- 2- carboxylate
Smiles: COC(=O)c1oc2c3c1cccc3C(=O)c1c2cccc1

STK542228
Synonyms: 2- (1,3- benzoxazol- 2- ylsulfanyl)- N'- [(1E)- 1- (3- nitrophenyl)ethylidene]acetohydrazide
Smiles: O=C(N/N=C(/c1cccc(c1)[N+](=O)[O-])\C)CSc1nc2c(o1)cccc2

STK542230
Synonyms: 4- [3,4- dimethoxy- 5- (methoxymethyl)phenyl]- 1,3- diphenyl- 4,8- dihydro- 1H- pyrazolo[3,4- e][1,4]thiazepin- 7(6H)- one
Smiles: COCc1cc(cc(c1OC)OC)C1SCC(=O)Nc2c1c(nn2c1ccccc1)c1ccccc1

STK542231
Synonyms: 1- amino- N,N- dibutyl- 8,8- dimethyl- 5- (morpholin- 4- yl)- 8,9- dihydro- 6H- pyrano[4,3- d]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: CCCCN(C(=O)c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCOCC1)CCCC

STK542232
Synonyms: N- (4- bromophenyl)- 11- (2- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Brc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccccc1F)C)c1ccccc1

STK542233
Synonyms: N- (4- ethylphenyl)- 11- (2- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccccc2F)c(nn1c1ccccc1)C

STK542234
Synonyms: N- (4- bromophenyl)- 2- {[2,2- dimethyl- 5- (morpholin- 4- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK542235
Synonyms: diphenylmethyl(6aS,6bR,9aS,10R)- 8- (naphthalen- 2- yl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxylate
Smiles: O=C([C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc3c(c1)cccc3)C=Cc1c2cccc1)OC(c1ccccc1)c1ccccc1

STK542236
Synonyms: ethyl(1'R,2'S,3R)- 2'- [(4- fluorophenyl)carbonyl]- 2- oxo- 1,1',2,2'- tetrahydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinoline]- 1'- carboxylate
Smiles: CCOC(=O)[C@@H]1N2c3ccccc3C=CC2[C@]2([C@@H]1C(=O)c1ccc(cc1)F)C(=O)Nc1c2cccc1

STK542238
Synonyms: 4- methyl- 1- {[2- oxo- 2- (piperidin- 1- yl)ethyl]sulfanyl}- 6,7,8,9- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: O=C(N1CCCCC1)CSc1nnc2n1c1sc3c(c1c(=O)n2C)CCCC3

STK542241
Synonyms: (2E)- 2- {2- [({5- [(4- methylbenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)acetyl]hydrazinylidene}- N- (4- methylphenyl)ethanethioamide
Smiles: O=C(CSc1nnc(s1)SCc1ccc(cc1)C)N/N=C/C(=S)Nc1ccc(cc1)C

STK542242
Synonyms: 2,2'- [(12- ethyl- 12- methyl- 12,13- dihydro- 10H- pyrano[4',3':4,5]thieno[3,2- e]bis[1,2,4]triazolo[4,3- a:4',3'- c]pyrimidine- 3,7- diyl)disulfanediyl]bis[1- (4- bromophenyl)ethanone]
Smiles: CCC1(C)OCc2c(C1)c1c3nnc(n3c3n(c1s2)c(SCC(=O)c1ccc(cc1)Br)nn3)SCC(=O)c1ccc(cc1)Br

STK542243
Synonyms: (2Z)- 2- cyano- N- (4- methoxyphenyl)- 2- [5- (4- methylbenzyl)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]ethanamide
Smiles: N#C/C(=C\1/SC(C(=O)N1c1ccccc1)Cc1ccc(cc1)C)/C(=O)Nc1ccc(cc1)OC

STK542244
Synonyms: 6- chloro- 4- phenyl- 2- [(2Z)- 2- (quinoxalin- 6- ylmethylidene)hydrazinyl]quinazoline
Smiles: Clc1ccc2c(c1)c(nc(n2)N/N=C\c1ccc2c(c1)nccn2)c1ccccc1

STK542247
Synonyms: 2- {[5- (3,4- dimethoxyphenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(E)- (4- nitrophenyl)methylidene]acetohydrazide
Smiles: CCn1c(SCC(=O)N/N=C/c2ccc(cc2)[N+](=O)[O-])nnc1c1ccc(c(c1)OC)OC

STK542248
Synonyms: 11- (4- chlorophenyl)- 10- methyl- N- (3- methylphenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Clc1ccc(cc1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cccc(c1)C)c1ccccc1

STK542249
Synonyms: N'- (propan- 2- ylidene)- 2- (4- propoxyphenyl)quinoline- 4- carbohydrazide
Smiles: CCCOc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)NN=C(C)C

STK542250
Synonyms: methyl4- {(E)- [2- ([1,2,4]triazolo[4,3- b]pyridazin- 6- yl)hydrazinylidene]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/Nc1ccc2n(n1)cnn2

STK542251
Synonyms: 3- {(Z)- [3- (4- methoxybenzyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- {[2- (morpholin- 4- yl)ethyl]amino}- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: COc1ccc(cc1)CN1C(=S)S/C(=C\c2c(NCCN3CCOCC3)nc3n(c2=O)cccc3)/C1=O

STK542252
Synonyms: methyl5- (3,5- dichlorophenyl)- 6a- methyl- 4,6- dioxo- 1,3a,4,5,6,6a- hexahydropyrrolo[3,4- c]pyrazole- 3- carboxylate
Smiles: COC(=O)C1=NNC2(C1C(=O)N(C2=O)c1cc(Cl)cc(c1)Cl)C

STK542253
Synonyms: 2- (1,3- benzoxazol- 2- ylsulfanyl)- N'- [(1Z)- 1- (3- bromophenyl)ethylidene]acetohydrazide
Smiles: O=C(N/N=C(\c1cccc(c1)Br)/C)CSc1nc2c(o1)cccc2

STK542254
Synonyms: 3- benzyl- 2- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 6- iodoquinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)C(=O)CSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)I

STK542258
Synonyms: (4Z)- 5- (3,4- dimethoxyphenyl)- 4- (1- hydroxyethylidene)- 1- (prop- 2- en- 1- yl)pyrrolidine- 2,3- dione
Smiles: C=CCN1C(=O)C(=O)/C(=C(\O)/C)/C1c1ccc(c(c1)OC)OC

STK542260
Synonyms: (3aS,6aS)- 5- (2- fluorophenyl)- 3- (4- nitrophenyl)- 1- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: O=C1[C@@H]2C(=NN([C@@H]2C(=O)N1c1ccccc1F)c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

STK542261
Synonyms: (4E)- 5- (2,4- dichlorophenyl)- 4- [hydroxy(4- methoxy- 3- methylphenyl)methylidene]- 1- (3- methoxypropyl)pyrrolidine- 2,3- dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/O)/C1c1ccc(cc1Cl)Cl

STK542262
Synonyms: 6- {(2E)- 2- [1- (4- fluorophenyl)ethylidene]hydrazinyl}[1,2,4]triazolo[4,3- b]pyridazine
Smiles: Fc1ccc(cc1)/C(=N/Nc1ccc2n(n1)cnn2)/C

STK542264
Synonyms: N- benzyl- 1- (4- ethoxyphenyl)- 2- {[(4- methylphenyl)sulfonyl]amino}- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCOc1ccc(cc1)n1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)C)C(=O)NCc1ccccc1

STK542265
Synonyms: 2- {[3- (4- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N- (2- methylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK542266
Synonyms: N- (4- methylphenyl)- 2- [(4- phenyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK542267
Synonyms: 2- (5- bromo- 2- methoxyphenyl)- 5- (4- fluorophenyl)- 4- phenyl- 1H- imidazole
Smiles: COc1ccc(cc1c1[nH]c(c(n1)c1ccccc1)c1ccc(cc1)F)Br

STK542270
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N'- [(E)- (4- fluorophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccccc1)N/N=C/c1ccc(cc1)F

STK542271
Synonyms: (4Z)- 5- (2- chlorophenyl)- 4- (1- hydroxyethylidene)- 1- [3- (morpholin- 4- yl)propyl]pyrrolidine- 2,3- dione
Smiles: C/C(=C\1/C(=O)C(=O)N(C1c1ccccc1Cl)CCCN1CCOCC1)/O

STK542272
Synonyms: 2- {[7,7- dimethyl- 5- oxo- 4- (2- phenylethyl)- 4,5,6,9- tetrahydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}- N- (3- methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CC(OC3)(C)C

STK542273
Synonyms: (3aR,6aS)- 5- (2,4- dimethylphenyl)- 3- (4- nitrophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)[C@H]2[C@@H](C1=O)ON=C2c1ccc(cc1)[N+](=O)[O-]

STK542274
Synonyms: 2- {[3- (4- methoxyphenyl)- 4- oxo- 3,4,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)c1CCCCc1s2

STK542275
Synonyms: (3aS,6aS)- 3- (4- bromophenyl)- 5- (3- fluorophenyl)- 1- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: Brc1ccc(cc1)C1=NN([C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)F)c1ccccc1

STK542276
Synonyms: (2Z)- N- (2- {(2E)- 2- [1- (2,4- dimethoxyphenyl)ethylidene]hydrazinyl}- 2- oxoethyl)- 3- (2- methoxyphenyl)prop- 2- enamide(non- preferredname)
Smiles: COc1ccc(c(c1)OC)/C(=N/NC(=O)CNC(=O)/C=C\c1ccccc1OC)/C

STK542277
Synonyms: 1- amino- N,N- diethyl- 8,8- dimethyl- 5- (morpholin- 4- yl)- 8,9- dihydro- 6H- pyrano[4,3- d]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: CCN(C(=O)c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCOCC1)CC

STK542278
Synonyms: ethyl[(4- amino- 4H- 1,2,4- triazol- 3- yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1nncn1N

STK542279
Synonyms: 6,6- dimethyl- 3- (4- methylphenyl)- 2- (methylsulfanyl)- 3,5,6,8- tetrahydro- 4H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(SC3)(C)C

STK542283
Synonyms: 2- [4- (4- chlorobenzyl)piperazin- 1- yl]- N'- [(E)- (2- fluorophenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)Cl)N/N=C/c1ccccc1F

STK542286
Synonyms: 2,6- bis(4- chlorophenyl)- N- hydroxy- 3,5- dimethylpiperidin- 4- imine
Smiles: CC1/C(=N/O)/C(C)C(NC1c1ccc(cc1)Cl)c1ccc(cc1)Cl

STK542287
Synonyms: 4- (3- chlorophenyl)- 2- (2,5- dimethoxyphenyl)- 5- phenyl- 1H- imidazole
Smiles: COc1ccc(c(c1)c1nc(c([nH]1)c1ccccc1)c1cccc(c1)Cl)OC

STK542289
Synonyms: 3- cyclohexyl- 2- methyl- 11- pentyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCCn1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)C1CCCCC1

STK542290
Synonyms: N- (2,5- dimethylphenyl)- 10- methyl- 8,11- diphenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1ccc(c(c1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccccc1)C)c1ccccc1)C

STK542293
Synonyms: N- {1- [1- (2- chloro- 6- fluorobenzyl)- 1H- benzimidazol- 2- yl]butyl}benzamide
Smiles: CCCC(c1nc2c(n1Cc1c(F)cccc1Cl)cccc2)NC(=O)c1ccccc1

STK542295
Synonyms: 2- (ethylsulfanyl)- 3- (2- methoxyphenyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4(6H)- one
Smiles: CCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1OC)CCCC3

STK542297
Synonyms: 6- iodo- 2- [(2- oxo- 2- phenylethyl)sulfanyl]- 3- phenylquinazolin- 4(3H)- one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)SCC(=O)c1ccccc1)c1ccccc1

STK542298
Synonyms: methylN- (6- ethoxy- 1,3- benzothiazol- 2- yl)- 3,3,3- trifluoro- 2- (propanoylamino)alaninate
Smiles: CCOc1ccc2c(c1)sc(n2)NC(C(F)(F)F)(C(=O)OC)NC(=O)CC

STK542299
Synonyms: methyl2- methyl- 6- (piperidin- 1- yl)- 4- (trifluoromethyl)- 4H- 1,3,5- oxadiazine- 4- carboxylate
Smiles: COC(=O)C1(N=C(OC(=N1)C)N1CCCCC1)C(F)(F)F

STK542300
Synonyms: 2- {[3- (3- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N- (2- phenylethyl)acetamide
Smiles: O=C(CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCCC3)NCCc1ccccc1

STK542302
Synonyms: 4- [5- (2- chloro- 7- methoxyquinolin- 3- yl)- 3- (3,4- dimethoxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- oxobutanoicacid
Smiles: COc1ccc2c(c1)nc(c(c2)C1CC(=NN1C(=O)CCC(=O)O)c1ccc(c(c1)OC)OC)Cl

STK542303
Synonyms: 4- (3- chlorophenyl)- 2- (3- methoxyphenyl)- 5- phenyl- 1H- imidazole
Smiles: COc1cccc(c1)c1nc(c([nH]1)c1ccccc1)c1cccc(c1)Cl

STK542305
Synonyms: N- benzyl- 2- {[3- (3- methylphenyl)- 4- oxo- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}acetamide
Smiles: O=C(NCc1ccccc1)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C

STK542306
Synonyms: 6- iodo- 2- (methylsulfanyl)- 3- (prop- 2- en- 1- yl)quinazolin- 4(3H)- one
Smiles: CSc1nc2ccc(cc2c(=O)n1CC=C)I

STK542307
Synonyms: (4Z)- 4- [ethoxy(hydroxy)methylidene]- 5- (3- nitrophenyl)- 1- phenylpyrrolidine- 2,3- dione
Smiles: CCO/C(=C\1/C(c2cccc(c2)[N+](=O)[O-])N(C(=O)C1=O)c1ccccc1)/O

STK542309
Synonyms: 2- {2- [3,4- dimethoxy- 5- (morpholin- 4- ylsulfonyl)phenyl]ethyl}- 1H- benzo[de]isoquinoline- 1,3(2H)- dione
Smiles: COc1c(OC)cc(cc1S(=O)(=O)N1CCOCC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK542310
Synonyms: 1- benzyl- 2'- [2- (difluoromethoxy)phenyl]- 7'- methoxy- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: COc1cccc2c1OC1(CCN(CC1)Cc1ccccc1)N1C2CC(=N1)c1ccccc1OC(F)F

STK542311
Synonyms: (4E)- 4- [(4- butoxy- 3- methylphenyl)(hydroxy)methylidene]- 5- (3- ethoxy- 4- hydroxyphenyl)- 1- (pyridin- 3- ylmethyl)pyrrolidine- 2,3- dione
Smiles: CCCCOc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)OCC)O)Cc1cccnc1)/O

STK542312
Synonyms: 8- fluoro- 3- {[(E)- (2- fluorophenyl)methylidene]amino}- 2- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Fc1ccc2c(c1)c1nc(C)n(c(=O)c1[nH]2)/N=C/c1ccccc1F

STK542313
Synonyms: ethyl{[3- (2- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 2- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1OC)CCCC3

STK542314
Synonyms: 1- [3,5- bis(4- bromophenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 3- (4- phenylpiperazin- 1- yl)propan- 1- one
Smiles: Brc1ccc(cc1)C1CC(=NN1C(=O)CCN1CCN(CC1)c1ccccc1)c1ccc(cc1)Br

STK542315
Synonyms: N- (2,4- dichlorophenyl)- 2- [(5- propyl- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl)sulfanyl]acetamide
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncnc3SCC(=O)Nc1ccc(cc1Cl)Cl

STK542316
Synonyms: 11- {[3- (dimethylamino)propyl]amino}- 2,3- dihydro- 1H- cyclopenta[4,5]pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: N#Cc1c2CCCc2c(n2c1nc1c2cccc1)NCCCN(C)C

STK542317
Synonyms: ethyl(8R,8aR)- 6- amino- 5,7,7- tricyano- 8- (2,5- dimethoxyphenyl)- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1cc(OC)ccc1OC)C(C(=C2C#N)N)(C#N)C#N

STK542318
Synonyms: 8- [(2- chloro- 6- fluorobenzyl)sulfanyl]- 1,3- dimethyl- 7- pentyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCn1c(SCc2c(F)cccc2Cl)nc2c1c(=O)n(c(=O)n2C)C

STK542319
Synonyms: 2- (4- {[(3,4- dimethoxyphenyl)carbonyl]carbamothioyl}piperazin- 1- yl)- 8- ethyl- 5- oxo- 5,8- dihydropyrido[2,3- d]pyrimidine- 6- carboxylicacid
Smiles: COc1cc(ccc1OC)C(=O)NC(=S)N1CCN(CC1)c1ncc2c(n1)n(CC)cc(c2=O)C(=O)O

STK542320
Synonyms: N- (3- chlorophenyl)- 10- methyl- 8,11- diphenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Clc1cccc(c1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccccc1)C)c1ccccc1

STK542323
Synonyms: 7- hydroxy- 3- (naphthalen- 2- yloxy)- 8- (piperidin- 1- ylmethyl)- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: Oc1ccc2c(c1CN1CCCCC1)oc(c(c2=O)Oc1ccc2c(c1)cccc2)C(F)(F)F

STK542326
Synonyms: 11- (4- bromophenyl)- 3- butyl- 2- methyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)Br

STK542327
Synonyms: 8- benzyl- 1- methyl- 4- (3- methylphenyl)- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Cc1cccc(c1)n1c(=O)c2c3CCN(Cc3sc2n2c1nnc2C)Cc1ccccc1

STK542328
Synonyms: 3- chloro- N- ({4- [(4,6- dimethylpyrimidin- 2- yl)sulfamoyl]phenyl}carbamothioyl)- 6- fluoro- 1- benzothiophene- 2- carboxamide
Smiles: S=C(NC(=O)c1sc2c(c1Cl)ccc(c2)F)Nc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(n1)C

STK542329
Synonyms: 2- {[2- (4- fluorophenyl)- 2- oxoethyl]sulfanyl}- 8,8- dimethyl- 3- (4- methylphenyl)- 3,6,8,9- tetrahydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 4- one
Smiles: Cc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)F)nc2c(c1=O)cc1c(n2)CC(OC1)(C)C

STK542330
Synonyms: 1- [(2,6- difluorobenzyl)oxy]- 3- (thiophen- 2- yl)quinoxalin- 2(1H)- one4- oxide
Smiles: Fc1cccc(c1COn1c(=O)c(c2cccs2)[n+](c2c1cccc2)[O-])F

STK542331
Synonyms: 3- {[(E)- (2- fluorophenyl)methylidene]amino}- 2,8- dimethyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)c1nc(C)n(c(=O)c1[nH]2)/N=C/c1ccccc1F

STK542332
Synonyms: N- (furan- 2- ylmethyl)- 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3)NCc1ccco1

STK542333
Synonyms: diphenylmethyl(8S,8aR,11aS)- 10- (4- methylphenyl)- 9,11- dioxo- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 8- carboxylate
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)OC(c2ccccc2)c2ccccc2)C=Cc2c1cccc2

STK542334
Synonyms: 2- {[7,7- dimethyl- 4- (3- methylphenyl)- 5- oxo- 4,5,6,9- tetrahydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CC(OC3)(C)C

STK542335
Synonyms: 4- hydroxy- 2- oxo- 1- propyl- N- (1,3- thiazol- 2- yl)- 1,2,5,6,7,8- hexahydroquinoline- 3- carboxamide
Smiles: CCCn1c2CCCCc2c(c(c1=O)C(=O)Nc1nccs1)O

STK542336
Synonyms: (3aS,6aS)- 3- (4- bromophenyl)- 5- (3- chlorophenyl)- 1- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: Brc1ccc(cc1)C1=NN([C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)Cl)c1ccccc1

STK542339
Synonyms: 11- (2- methoxyphenyl)- 10- methyl- N- (2- methylphenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccccc1C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccccc1C)nc1c2cccc1

STK542341
Synonyms: 2- (hexylsulfanyl)- 6,6- dimethyl- 3- phenyl- 3,5,6,8- tetrahydro- 4H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CCCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(SC3)(C)C

STK542342
Synonyms: (6aR,6bS,9aR,10S)- 10- [(4- chlorophenyl)carbonyl]- 8- (4- methoxyphenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)c1ccc(cc1)Cl

STK542343
Synonyms: 7- (4- {[(3,5- dimethoxyphenyl)carbonyl]carbamothioyl}piperazin- 1- yl)- 1- ethyl- 6- fluoro- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: COc1cc(OC)cc(c1)C(=O)NC(=S)N1CCN(CC1)c1cc2n(CC)cc(c(=O)c2cc1F)C(=O)O

STK542344
Synonyms: N- butyl- 2- cyano- 2- [3- (morpholin- 4- yl)quinoxalin- 2- yl]acetamide
Smiles: CCCCNC(=O)C(c1nc2ccccc2nc1N1CCOCC1)C#N

STK542346
Synonyms: 1- [(2,6- difluorobenzyl)oxy]- 3- methylquinoxalin- 2(1H)- one4- oxide
Smiles: Fc1cccc(c1COn1c(=O)c(C)[n+](c2c1cccc2)[O-])F

STK542347
Synonyms: ethyl(8S,8aR)- 6- amino- 5,7,7- tricyano- 8- [3- ethoxy- 4- (propan- 2- yloxy)phenyl]- 3,7,8,8a- tetrahydroisoquinoline- 2(1H)- carboxylate
Smiles: CCOc1cc(ccc1OC(C)C)[C@@H]1[C@H]2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(=O)OCC

STK542348
Synonyms: diphenylmethyl(8S,8aR,11aS)- 10- (3- chlorophenyl)- 9,11- dioxo- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 8- carboxylate
Smiles: Clc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)OC(c2ccccc2)c2ccccc2)C=Cc2c1cccc2

STK542349
Synonyms: 3- [(Z)- {3- [2- (3,4- dimethoxyphenyl)ethyl]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene}methyl]- 2- [(2- methylpropyl)amino]- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: COc1cc(CCN2C(=S)S/C(=C\c3c(NCC(C)C)nc4n(c3=O)cccc4)/C2=O)ccc1OC

STK542350
Synonyms: (6aR,6bS,9aR,10S)- 8- (1,3- benzodioxol- 5- yl)- 10- [(3- nitrophenyl)carbonyl]- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: O=C([C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc3c(c1)OCO3)C=Cc1c2cccc1)c1cccc(c1)[N+](=O)[O-]

STK542351
Synonyms: 2- {[11- (2- methylpropyl)- 7,8,9,10- tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 3- yl]sulfanyl}- N- (4- phenylbutan- 2- yl)acetamide
Smiles: CC(Cc1nc2sc3c(c2c2c1CCCC2)ncn1c3nnc1SCC(=O)NC(CCc1ccccc1)C)C

STK542352
Synonyms: 2- methyl- 11- (3- methylphenyl)- 3- (2- phenylethyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Cc1cccc(c1)n1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)CCc1ccccc1

STK542354
Synonyms: 3- (4- fluorobenzyl)- 7,8- dimethoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1cc2c(cc1OC)[nH]c1c2ncn(c1=O)Cc1ccc(cc1)F

STK542355
Synonyms: (6aR,6bS,9aR,10S)- 10- [(4- bromophenyl)carbonyl]- 2- chloro- 8- (naphthalen- 1- yl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Clc1ccc2c(c1)N1[C@H](C=C2)[C@@H]2[C@H]([C@H]1C(=O)c1ccc(cc1)Br)C(=O)N(C2=O)c1cccc2c1cccc2

STK542356
Synonyms: 3- [(Z)- (3- cyclopentyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 2- (4- methylpiperazin- 1- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CN1CCN(CC1)c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCCC1

STK542359
Synonyms: (9E)- 9- (3- methoxybenzylidene)- 3,5- bis(3- methoxyphenyl)- 6,7,8,9- tetrahydro- 5H- [1,3]thiazolo[2,3- b]quinazoline
Smiles: COc1cccc(c1)/C=C/1\CCCC2=C1N=c1scc(n1C2c1cccc(c1)OC)c1cccc(c1)OC

STK542360
Synonyms: methyl(1- {3- [(Z)- (3- cyclopentyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 4- oxo- 4H- pyrido[1,2- a]pyrimidin- 2- yl}- 3- oxopiperazin- 2- yl)acetate
Smiles: COC(=O)CC1C(=O)NCCN1c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCCC1

STK542362
Synonyms: 2- amino- 1- (3- chloro- 4- methoxyphenyl)- N- (4- ethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCOc1ccc(cc1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)OC

STK542364
Synonyms: 3,7- bis(benzylsulfanyl)- 12- ethyl- 12- methyl- 12,13- dihydro- 10H- pyrano[4',3':4,5]thieno[3,2- e]bis[1,2,4]triazolo[4,3- a:4',3'- c]pyrimidine
Smiles: CCC1(C)OCc2c(C1)c1c3nnc(n3c3n(c1s2)c(SCc1ccccc1)nn3)SCc1ccccc1

STK542365
Synonyms: 2- (4- methoxybenzyl)- 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: COc1ccc(cc1)Cc1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

STK542369
Synonyms: 2- (ethylsulfanyl)- 8,8- dimethyl- 3- (3- methylphenyl)- 3,6,8,9- tetrahydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 4- one
Smiles: CCSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1cccc(c1)C

STK542370
Synonyms: N- (2- methoxyphenyl)- 2- {[3- (2- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: COc1ccccc1NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3

STK542371
Synonyms: N- (4- bromophenyl)- 4- hydroxy- 2- oxo- 1,2,5,6,7,8- hexahydroquinoline- 3- carboxamide
Smiles: Brc1ccc(cc1)NC(=O)c1c(=O)[nH]c2c(c1O)CCCC2

STK542372
Synonyms: 2- (1,3- benzoxazol- 2- ylsulfanyl)- N'- [(E)- (4- ethylphenyl)methylidene]acetohydrazide
Smiles: CCc1ccc(cc1)/C=N/NC(=O)CSc1nc2c(o1)cccc2

STK542373
Synonyms: ethyl5- chloro- 3- [(ethylcarbamothioyl)amino]- 1H- indole- 2- carboxylate
Smiles: CCNC(=S)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OCC

STK542374
Synonyms: 4- [(3aR,6aS)- 3- (4- nitrophenyl)- 4,6- dioxo- 3a,4,6,6a- tetrahydro- 5H- pyrrolo[3,4- d][1,2]oxazol- 5- yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C(=NO2)c1ccc(cc1)[N+](=O)[O-]

STK542376
Synonyms: 3- {(Z)- [3- (1,3- benzodioxol- 5- ylmethyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 9- methyl- 2- (thiomorpholin- 4- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: S=C1S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCSCC2)/C(=O)N1Cc1ccc2c(c1)OCO2

STK542377
Synonyms: (8S,8aR)- 6- amino- 2- benzyl- 8- (3,4- diethoxyphenyl)- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: CCOc1cc(ccc1OCC)[C@@H]1[C@H]2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)Cc1ccccc1

STK542378
Synonyms: N- [4- (acetylamino)phenyl]- 2- [(3- cyclohexyl- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1C1CCCCC1)CCCCC3

STK542379
Synonyms: ethyl2- [(3- chloroquinoxalin- 2- yl)amino]- 4- (4- methylphenyl)thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccc(cc1)C)Nc1nc2ccccc2nc1Cl

STK542380
Synonyms: 3- {(Z)- [3- (4- methoxybenzyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (thiomorpholin- 4- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: COc1ccc(cc1)CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCSCC2)/C1=O

STK542381
Synonyms: 2'- (5- bromofuran- 2- yl)- 4- phenyl- 1',10b'- dihydrospiro[cyclohexane- 1,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: Brc1ccc(o1)C1=NN2C(C1)c1ccccc1OC12CCC(CC1)c1ccccc1

STK542382
Synonyms: N- (diphenylmethyl)- 2- [(4- phenyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl)sulfanyl]acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK542383
Synonyms: 2- amino- N- (4- fluorobenzyl)- 1- [2- (2- fluorophenyl)ethyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Fc1ccc(cc1)CNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccccc1F

STK542384
Synonyms: ethyl[(3- benzyl- 5- ethyl- 5- methyl- 4- oxo- 3,4,5,6- tetrahydrobenzo[h]quinazolin- 2- yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1nc2c3ccccc3CC(c2c(=O)n1Cc1ccccc1)(C)CC

STK542385
Synonyms: (6aR,6bS,9aR,10S)- 8- (3,5- dichlorophenyl)- 10- [(4- methoxyphenyl)carbonyl]- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1cc(Cl)cc(c1)Cl)C=Cc1c2cccc1

STK542386
Synonyms: 3- benzyl- 2- [(Z)- (1- ethyl- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene)methyl]- 6- iodoquinazolin- 4(3H)- one
Smiles: CCN1C(=O)/C(=C\c2nc3ccc(cc3c(=O)n2Cc2ccccc2)I)/c2c1cccc2

STK542387
Synonyms: 2- {4- [2- (furan- 2- ylcarbonyl)hydrazinyl]- 4- oxobutan- 2- yl}- 5- methylhexanoicacid
Smiles: CC(CCC(C(CC(=O)NNC(=O)c1ccco1)C)C(=O)O)C

STK542388
Synonyms: 3,7- bis(benzylsulfanyl)- 11- tert- butyl- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:4',3'- c]pyrimidine
Smiles: CC(C1CCc2c(C1)sc1c2c2nnc(n2c2n1c(SCc1ccccc1)nn2)SCc1ccccc1)(C)C

STK542389
Synonyms: 9- [(3- methylbutyl)sulfanyl]- 8- (prop- 2- en- 1- yl)- 5,8- dihydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 7(6H)- one
Smiles: C=CCn1c(SCCC(C)C)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK542390
Synonyms: diphenylmethyl(6aR,6bS,9aR,10S)- 8- (4- methylphenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxylate
Smiles: Cc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)OC(c1ccccc1)c1ccccc1

STK542391
Synonyms: (6aR,6bS,9aR,10S)- N- (4- chlorophenyl)- 8- (4- methoxyphenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: COc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)Nc1ccc(cc1)Cl

STK542392
Synonyms: 2- {[3- (2- methoxyphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: COc1ccccc1n1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK542394
Synonyms: methyl2- (acetylamino)- N- 1,3- benzothiazol- 2- yl- 3,3,3- trifluoroalaninate
Smiles: COC(=O)C(C(F)(F)F)(Nc1nc2c(s1)cccc2)NC(=O)C

STK542395
Synonyms: 2- amino- N- cyclopropyl- 1- (3,4- dimethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1cc(ccc1OC)n1c2nc3ccccc3nc2c(c1N)C(=O)NC1CC1

STK542397
Synonyms: (2E,6E)- 2- (furan- 2- ylmethylidene)- 6- (4- methoxybenzylidene)cyclohexanone
Smiles: COc1ccc(cc1)/C=C/1\CCC/C(=C\c2ccco2)/C1=O

STK542398
Synonyms: 4- hydrazinyl- 6- (propan- 2- yl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: NNc1ncnc2c1c1CC(OCc1s2)C(C)C

STK542399
Synonyms: 2- [4- (3- chlorophenyl)piperazin- 1- yl]- 1- (5- methoxy- 1H- indol- 3- yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCN(CC1)c1cccc(c1)Cl

STK542400
Synonyms: 3- (4- methylphenyl)- 2- {[2- oxo- 2- (piperidin- 1- yl)ethyl]sulfanyl}- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: Cc1ccc(cc1)n1c(SCC(=O)N2CCCCC2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK542401
Synonyms: 4- fluoro- N- [1- (1- phenylethyl)- 3- (phenylsulfonyl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl]benzenesulfonamide
Smiles: Fc1ccc(cc1)S(=O)(=O)Nc1n(C(c2ccccc2)C)c2c(c1S(=O)(=O)c1ccccc1)nc1c(n2)cccc1

STK542402
Synonyms: N- [4- (acetylamino)phenyl]- 2- {[3- (3- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCCC3

STK542403
Synonyms: N- (4- butylphenyl)- 11- (4- tert- butylphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCCCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(C)(C)C)c(nn1c1ccccc1)C

STK542406
Synonyms: methyl4- [6- (1,3- benzodioxol- 5- ylamino)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 11- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1ccc3c(c1)OCO3)nc1c2cccc1

STK542408
Synonyms: 1- {[(2Z)- 3- chlorobut- 2- en- 1- yl]sulfanyl}- 4- methyl- 6,7,8,9- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: C/C(=C/CSc1nnc2n1c1sc3c(c1c(=O)n2C)CCCC3)/Cl

STK542409
Synonyms: (5Z)- 1- (2- methoxyphenyl)- 5- [(1- methyl- 1H- pyrrol- 2- yl)methylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccccc1N1C(=O)NC(=O)/C(=C/c2cccn2C)/C1=O

STK542411
Synonyms: (2Z)- 2- (5- benzyl- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene)- N- (4- chlorophenyl)- 2- cyanoethanamide
Smiles: N#C/C(=C\1/SC(C(=O)N1c1ccccc1)Cc1ccccc1)/C(=O)Nc1ccc(cc1)Cl

STK542412
Synonyms: 2- [(3- hydroxypropyl)amino]- 3- {(Z)- [3- (4- methoxybenzyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 7- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: OCCCNc1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)OC)C

STK542413
Synonyms: 6- bromo- 3- [5- (4- bromophenyl)- 1- (methylsulfonyl)- 4,5- dihydro- 1H- pyrazol- 3- yl]- 2- methyl- 4- phenylquinoline
Smiles: Brc1ccc(cc1)C1CC(=NN1S(=O)(=O)C)c1c(C)nc2c(c1c1ccccc1)cc(cc2)Br

STK542414
Synonyms: 9'- bromo- 2'- (3,4- dichlorophenyl)- 1- methyl- 1',10b'- dihydrospiro[piperidine- 4,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: CN1CCC2(CC1)Oc1ccc(cc1C1N2N=C(C1)c1ccc(c(c1)Cl)Cl)Br

STK542416
Synonyms: dipropan- 2- yl[(3,4- dimethoxyphenyl)(phenylamino)methyl]phosphonate
Smiles: COc1cc(ccc1OC)C(P(=O)(OC(C)C)OC(C)C)Nc1ccccc1

STK542417
Synonyms: N- (naphthalen- 1- yl)- 2- {[4- oxo- 3- (prop- 2- en- 1- yl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc3c2cccc3)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK542419
Synonyms: 2- ({5- [(4- methylbenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)- N'- [(E)- (1- methyl- 1H- pyrrol- 2- yl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccc(cc1)C)N/N=C/c1cccn1C

STK542420
Synonyms: N'- [(E)- 1,3- benzodioxol- 5- ylmethylidene]- 1- benzofuran- 2- carbohydrazide
Smiles: O=C(c1cc2c(o1)cccc2)N/N=C/c1ccc2c(c1)OCO2

STK542421
Synonyms: (3aS,6aS)- 3- (4- bromophenyl)- 5- (2- methyl- 4- nitrophenyl)- 1- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: Brc1ccc(cc1)C1=NN([C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1C)[N+](=O)[O-])c1ccccc1

STK542422
Synonyms: 2- {[5- (ethylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}- N- (furan- 2- ylmethyl)acetamide
Smiles: CCSc1nc2sc3c(c2c2n1c(SCC(=O)NCc1ccco1)nn2)CCCC3

STK542424
Synonyms: (4E)- 5- (4- bromophenyl)- 4- [(4- ethoxyphenyl)(hydroxy)methylidene]- 1- (pyridin- 3- ylmethyl)pyrrolidine- 2,3- dione
Smiles: CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)Br)Cc1cccnc1)/O

STK542425
Synonyms: N'- [(E)- (2- methoxynaphthalen- 1- yl)methylidene]- 2- ({5- [(4- methylbenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)acetohydrazide
Smiles: COc1ccc2c(c1/C=N/NC(=O)CSc1nnc(s1)SCc1ccc(cc1)C)cccc2

STK542426
Synonyms: ethyl3- {[3- (3,3- dimethylpiperidin- 1- yl)propanoyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCCC(C1)(C)C)cc(cc2)OC

STK542427
Synonyms: 2- [(4- methoxybenzyl)sulfanyl]- 6,6- dimethyl- 3- (3- methylphenyl)- 3,5,6,8- tetrahydro- 4H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: COc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(SC3)(C)C

STK542429
Synonyms: N- (2,4- dichlorophenyl)- 2- {[7,7- dimethyl- 5- oxo- 4- (2- phenylethyl)- 4,5,6,9- tetrahydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CC(OC3)(C)C

STK542432
Synonyms: 9- (4- chlorophenyl)- 2- (naphthalen- 1- yl)tetrahydro- 5H- pyrazolo[1,2- a]pyrrolo[3,4- c]pyrazole- 1,3(2H,3aH)- dione
Smiles: Clc1ccc(cc1)C1N2CCCN2C2C1C(=O)N(C2=O)c1cccc2c1cccc2

STK542433
Synonyms: N- (4- acetylphenyl)- 2- {[5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)C(=O)C)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK542434
Synonyms: N- [1- (1- benzyl- 1H- benzimidazol- 2- yl)pentyl]benzamide
Smiles: CCCCC(c1nc2c(n1Cc1ccccc1)cccc2)NC(=O)c1ccccc1

STK542436
Synonyms: [11- (2- ethoxyphenyl)- 1- hydroxy- 3,3- dimethyl- 2,3,4,11- tetrahydro- 10H- dibenzo[b,e][1,4]diazepin- 10- yl](phenyl)methanone
Smiles: CCOc1ccccc1C1C2=C(O)CC(CC2=Nc2c(N1C(=O)c1ccccc1)cccc2)(C)C

STK542437
Synonyms: 2- (3- bromophenyl)- 1- (4- ethoxyphenyl)- 1H- imidazo[4,5- b]quinoxaline
Smiles: CCOc1ccc(cc1)n1c(nc2c1nc1ccccc1n2)c1cccc(c1)Br

STK542438
Synonyms: 9- methyl- 3- {(Z)- [4- oxo- 3- (propan- 2- yl)- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (thiomorpholin- 4- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCSCC2)/C1=O)C

STK542439
Synonyms: (4E)- 5- (4- chlorophenyl)- 4- (1- hydroxyethylidene)- 1- (pyridin- 3- ylmethyl)pyrrolidine- 2,3- dione
Smiles: Clc1ccc(cc1)C1/C(=C(\O)/C)/C(=O)C(=O)N1Cc1cccnc1

STK542440
Synonyms: (4E)- 4- [hydroxy(4- methoxyphenyl)methylidene]- 1- (5- methyl- 1,3,4- thiadiazol- 2- yl)- 5- (3- phenoxyphenyl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)/C(=C\1/C(c2cccc(c2)Oc2ccccc2)N(C(=O)C1=O)c1nnc(s1)C)/O

STK542443
Synonyms: (2E)- N- [(3- chloro- 2- hydroxy- 5- nitrophenyl)carbamothioyl]- 3- phenylprop- 2- enamide
Smiles: S=C(Nc1cc(cc(c1O)Cl)[N+](=O)[O-])NC(=O)/C=C/c1ccccc1

STK542445
Synonyms: 11- (4- ethoxyphenyl)- 10- methyl- 8- phenyl- N- [3- (trifluoromethyl)phenyl]- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: CCOc1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(Nc1cccc(c1)C(F)(F)F)nc1c2cccc1

STK542446
Synonyms: 3- [(Z)- (3- ethyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 2- [4- (2- methoxyphenyl)piperazin- 1- yl]- 9- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccccc2OC)/C1=O

STK542448
Synonyms: 3- (4- bromophenyl)- 6- iodo- 2- [(E)- 2- (2- methylphenyl)ethenyl]quinazolin- 4(3H)- one
Smiles: Brc1ccc(cc1)n1c(/C=C/c2ccccc2C)nc2c(c1=O)cc(cc2)I

STK542449
Synonyms: 2- cyano- N- cyclopropyl- 2- [3- (piperidin- 1- yl)quinoxalin- 2- yl]acetamide
Smiles: N#CC(c1nc2ccccc2nc1N1CCCCC1)C(=O)NC1CC1

STK542453
Synonyms: N- (4- fluorophenyl)- 6- methyl- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- amine
Smiles: CC1CCc2c(C1)c1c(ncnc1s2)Nc1ccc(cc1)F

STK542454
Synonyms: 2- {4- [(4- bromophenyl)sulfonyl]piperazin- 1- yl}- N'- [(E)- pyridin- 3- ylmethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br)N/N=C/c1cccnc1

STK542455
Synonyms: N- (4- methylphenyl)- 2- [(5,10,10- trimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc2n1c(C)nc1c2c2CC(C)(C)OCc2s1

STK542456
Synonyms: (2E)- 1- [3- (4- bromophenyl)- 5- (4- methoxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 3- phenylprop- 2- en- 1- one
Smiles: COc1ccc(cc1)C1CC(=NN1C(=O)/C=C/c1ccccc1)c1ccc(cc1)Br

STK542457
Synonyms: 9- methyl- 3- {(Z)- [3- (4- methylbenzyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (thiomorpholin- 4- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: Cc1ccc(cc1)CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCSCC2)/C1=O

STK542458
Synonyms: 2- [(4- methoxybenzyl)sulfanyl]- 8,8- dimethyl- 3- (4- methylphenyl)- 3,6,8,9- tetrahydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 4- one
Smiles: COc1ccc(cc1)CSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1ccc(cc1)C

STK542459
Synonyms: methylN- [(2,4- dichlorophenyl)carbonyl]- 3,3,3- trifluoro- 2- [2- (4- nitrophenyl)hydrazinyl]alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccc(cc1Cl)Cl)NNc1ccc(cc1)[N+](=O)[O-]

STK542461
Synonyms: (3aS,6aS)- 5- (3- fluorophenyl)- 3- (4- nitrophenyl)- 1- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: Fc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)N(N=C2c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK542462
Synonyms: 3- {(Z)- [3- (2- chlorobenzyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (4- ethylpiperazin- 1- yl)- 9- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccccc1Cl

STK542463
Synonyms: 10- methyl- N- (2- methylphenyl)- 8- phenyl- 11- (thiophen- 2- yl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1ccccc1Nc1nc2ccccc2n2c1=Nc1c(C2c2cccs2)c(nn1c1ccccc1)C

STK542464
Synonyms: 11- (3- bromophenyl)- N- (3- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Brc1cccc(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cccc(c1)F)c1ccccc1

STK542465
Synonyms: 2- [4- (5- chloro- 2- methylphenyl)piperazin- 1- yl]- 1- (8- methoxy- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)ethanone
Smiles: COc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)CN1CCN(CC1)c1cc(Cl)ccc1C

STK542467
Synonyms: (6aR,6bS,9aR,10S)- N- (4- chlorophenyl)- 8- (4- fluorophenyl)- 7,9- dioxo- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: Fc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)Nc1ccc(cc1)Cl

STK542468
Synonyms: (8R,8aR)- 6- amino- 8- (2,5- dichlorophenyl)- 2- ethyl- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: CCN1CC=C2[C@H](C1)[C@@H](c1cc(Cl)ccc1Cl)C(C(=C2C#N)N)(C#N)C#N

STK542470
Synonyms: 10H- spiro[acridine- 9,3'- benzo[f]chromene]
Smiles: c1ccc2c(c1)Nc1c(C32C=Cc2c(O3)ccc3c2cccc3)cccc1

STK542471
Synonyms: 2- [(4- methoxybenzyl)sulfanyl]- 6,6- dimethyl- 3- (4- methylphenyl)- 3,5,6,8- tetrahydro- 4H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: COc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(SC3)(C)C

STK542472
Synonyms: 2- {[2- oxo- 2- (piperidin- 1- yl)ethyl]sulfanyl}- 3- (2- phenylethyl)- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4(6H)- one
Smiles: O=C(N1CCCCC1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3

STK542474
Synonyms: 2- {[3- (3- methylphenyl)- 4- oxo- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- (4- phenylbutan- 2- yl)acetamide
Smiles: CC(NC(=O)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C)CCc1ccccc1

STK542475
Synonyms: (4- chlorophenyl){(1R,2S,3R,3aR)- 2- [4- (dimethylamino)phenyl]- 3- nitro- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinolin- 1- yl}methanone
Smiles: Clc1ccc(cc1)C(=O)[C@H]1[C@H](c2ccc(cc2)N(C)C)[C@H]([C@@H]2N1c1ccccc1C=C2)[N+](=O)[O-]

STK542479
Synonyms: 1- benzyl- N- (3- bromophenyl)- 4- hydroxy- 2- oxo- 1,2,5,6,7,8- hexahydroquinoline- 3- carboxamide
Smiles: Brc1cccc(c1)NC(=O)c1c(O)c2CCCCc2n(c1=O)Cc1ccccc1

STK542480
Synonyms: 2- {[3- cyano- 4- (2,3- dichlorophenyl)- 5- oxo- 1,4,5,6,7,8- hexahydroquinolin- 2- yl]sulfanyl}- N- (3- methoxyphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)OC)NC2=C(C1c1cccc(c1Cl)Cl)C(=O)CCC2

STK542481
Synonyms: butyl4- {[(pyridin- 3- ylcarbonyl)carbamothioyl]amino}benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)NC(=S)NC(=O)c1cccnc1

STK542482
Synonyms: 3- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 11- (4- methoxyphenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccc(cc1)n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)c1c(C)n(n(c1=O)c1ccccc1)C

STK542483
Synonyms: 2- {[6,6- dimethyl- 3- (3- methylphenyl)- 4- oxo- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- (4- phenylbutan- 2- yl)acetamide
Smiles: CC(NC(=O)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)(C)C)CCc1ccccc1

STK542484
Synonyms: (2E)- 3- [4- (propan- 2- yl)phenyl]- N- {[4- (1,3- thiazol- 2- ylsulfamoyl)phenyl]carbamothioyl}prop- 2- enamide
Smiles: S=C(Nc1ccc(cc1)S(=O)(=O)Nc1nccs1)NC(=O)/C=C/c1ccc(cc1)C(C)C

STK542485
Synonyms: ethyl4- [2,2- dimethyl- 5- (morpholin- 4- yl)- 8- oxo- 1,8- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 9(4H)- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1cnc2c(c1=O)sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK542486
Synonyms: (8R,8aR)- 6- amino- 2- benzyl- 8- (2,5- dimethoxyphenyl)- 2,3,8,8a- tetrahydroisoquinoline- 5,7,7(1H)- tricarbonitrile
Smiles: COc1ccc(c(c1)[C@@H]1[C@H]2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)Cc1ccccc1)OC

STK542487
Synonyms: N'- [(E)- (3,4- dimethoxyphenyl)methylidene]- 6- oxo- 1,6- dihydropyridazine- 3- carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2ccc(=O)[nH]n2)ccc1OC

STK542490
Synonyms: 6,6- dimethyl- 2- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 5,8- dihydro- 6H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CC(=C)CSc1nc(N)c2c(n1)sc1c2CC(SC1)(C)C

STK542491
Synonyms: (3aR,6aS)- 5- (4- chlorophenyl)- 3- (4- nitrophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: Clc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)ON=C2c1ccc(cc1)[N+](=O)[O-]

STK542493
Synonyms: 2- cyano- N- (2- methoxyethyl)- 2- [3- (morpholin- 4- yl)quinoxalin- 2- yl]acetamide
Smiles: COCCNC(=O)C(c1nc2ccccc2nc1N1CCOCC1)C#N

STK542494
Synonyms: methyl(1R,2R,3R,3aS)- 3- cyano- 2- phenyl- 1- (phenylcarbonyl)- 1,2,3,3a- tetrahydropyrrolo[1,2- a]quinoline- 3- carboxylate
Smiles: COC(=O)[C@]1(C#N)[C@@H](c2ccccc2)[C@@H](N2[C@H]1C=Cc1c2cccc1)C(=O)c1ccccc1

STK542496
Synonyms: 1- (3,5- dimethylpiperidin- 1- yl)- 3- methyl- 2- (3- methylbutyl)pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: N#Cc1c(C)c(CCC(C)C)c(n2c1nc1c2cccc1)N1CC(C)CC(C1)C

STK542498
Synonyms: (4E)- 5- (3- ethoxy- 4- hydroxyphenyl)- 4- {hydroxy[3- methyl- 4- (2- methylpropoxy)phenyl]methylidene}- 1- (3- methoxypropyl)pyrrolidine- 2,3- dione
Smiles: COCCCN1C(c2ccc(c(c2)OCC)O)/C(=C(/c2ccc(c(c2)C)OCC(C)C)\O)/C(=O)C1=O

STK542499
Synonyms: N- (3- bromophenyl)- 4- hydroxy- 2- oxo- 1- propyl- 1,2,5,6,7,8- hexahydroquinoline- 3- carboxamide
Smiles: CCCn1c2CCCCc2c(c(c1=O)C(=O)Nc1cccc(c1)Br)O

STK542500
Synonyms: N- [(E)- {4- methoxy- 3- [(pyridin- 2- yloxy)methyl]phenyl}methylidene]- 4,5- dihydro- 3H- pyrimido[5,4- b]indol- 3- amine
Smiles: COc1ccc(cc1COc1ccccn1)/C=N/N1C=Nc2c(C1)[nH]c1c2cccc1

STK542501
Synonyms: 2- (8- cyclohexyl- 1,2,3a,4,5,6- hexahydro- 3H- pyrazino[3,2,1- jk]carbazol- 3- yl)- N'- [(Z)- (2- fluorophenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCn2c3C1CCCc3c1c2ccc(c1)C1CCCCC1)N/N=C\c1ccccc1F

STK542502
Synonyms: (1E)- 1- {2- [2- (4- bromophenoxy)ethoxy]- 3,5- dichlorobenzylidene}- 2- (4- nitrophenyl)hydrazine
Smiles: Clc1cc(/C=N/Nc2ccc(cc2)[N+](=O)[O-])c(c(c1)Cl)OCCOc1ccc(cc1)Br

STK542503
Synonyms: methyl7- (4- ethoxyphenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: CCOc1ccc(cc1)N1C(=O)CC2(C1=O)NN=C(C2)C(=O)OC

STK542505
Synonyms: 8- chloro- 4- (3- methylpiperidin- 1- yl)- 5H- pyrimido[5,4- b]indole
Smiles: CC1CCCN(C1)c1ncnc2c1[nH]c1c2cc(cc1)Cl

STK542507
Synonyms: (6aS,6bR,9aS,10R)- 10- (1H- benzotriazol- 1- ylcarbonyl)- 8- (2,4- dimethylphenyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)n1nnc2c1cccc2

STK542508
Synonyms: (4E)- 1- [2- (dimethylamino)ethyl]- 4- [hydroxy(4- methoxy- 2- methylphenyl)methylidene]- 5- (4- hydroxy- 3- methoxyphenyl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(c(c1)C)/C(=C\1/C(c2ccc(c(c2)OC)O)N(C(=O)C1=O)CCN(C)C)/O

STK542509
Synonyms: N- (3- chlorophenyl)- 11- (2- methoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: COc1ccccc1C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cccc(c1)Cl)c1ccccc1

STK542510
Synonyms: 1- ethyl- 6- fluoro- 7- (4- {[(3- fluorophenyl)carbonyl]carbamothioyl}piperazin- 1- yl)- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=S)NC(=O)c1cccc(c1)F)c(c2)F

STK542511
Synonyms: 2- amino- N- (furan- 2- ylmethyl)- 1- hexyl- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CCCCCCn1c2nc3ccccc3nc2c(c1N)C(=O)NCc1ccco1

STK542512
Synonyms: N- (3,5- dimethylphenyl)- 11- (2- fluorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1cc(cc(c1)C)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1ccccc1F)C)c1ccccc1

STK542513
Synonyms: 2- {[6,6- dimethyl- 3- (4- methylphenyl)- 4- oxo- 3,5,6,8- tetrahydro- 4H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)c1CC(C)(C)SCc1s2

STK542516
Synonyms: 1- (1,3- benzodioxol- 5- ylmethyl)- N- benzyl- 2- {[(4- methylphenyl)sulfonyl]amino}- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1c(C(=O)NCc2ccccc2)c2c(n1Cc1ccc3c(c1)OCO3)nc1c(n2)cccc1

STK542518
Synonyms: 2- amino- 1- (2,4- dimethoxyphenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carbonitrile
Smiles: COc1cc(OC)ccc1n1c2nc3ccccc3nc2c(c1N)C#N

STK542519
Synonyms: N'- [(1Z)- 1- (3- bromophenyl)ethylidene]- 2- {[5- (4- methoxyphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)N/N=C(\c1cccc(c1)Br)/C

STK542520
Synonyms: N'- [(E)- (5- bromo- 2- methoxyphenyl)methylidene]- 2- {[5- (3,4- dimethoxyphenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetohydrazide
Smiles: COc1cc(ccc1OC)c1nnc(n1CC)SCC(=O)N/N=C/c1cc(Br)ccc1OC

STK542521
Synonyms: N- {3- [(4- butylphenyl)amino]quinoxalin- 2- yl}- 2,5- dichlorobenzenesulfonamide
Smiles: CCCCc1ccc(cc1)Nc1nc2ccccc2nc1NS(=O)(=O)c1cc(Cl)ccc1Cl

STK542522
Synonyms: (3aR,4S,9aR,9bS)- 4- [(4- bromophenyl)carbonyl]- 2- (3- fluorophenyl)- 8- (phenylcarbonyl)- 3a,4,9a,9b- tetrahydro- 1H- pyrrolo[3,4- a]indolizine- 1,3(2H)- dione
Smiles: Fc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccc(cc2)Br)C=CC(=C1)C(=O)c1ccccc1

STK542523
Synonyms: 4,5- dimethyl- 2- {[3- (morpholin- 4- yl)quinoxalin- 2- yl]amino}thiophene- 3- carbonitrile
Smiles: N#Cc1c(Nc2nc3ccccc3nc2N2CCOCC2)sc(c1C)C

STK542524
Synonyms: 1- (4- methylphenyl)- 2- phenyl- 1H- imidazo[4,5- b]quinoxaline
Smiles: Cc1ccc(cc1)n1c(nc2c1nc1ccccc1n2)c1ccccc1

STK542525
Synonyms: 7- (heptylsulfanyl)- 4- phenyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: CCCCCCCSc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK542526
Synonyms: 2- amino- 1- (4- ethylphenyl)- N- (prop- 2- en- 1- yl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: C=CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)CC

STK542527
Synonyms: 3- [(1- phenylethyl)amino]- 1- (4- propoxyphenyl)pyrrolidine- 2,5- dione
Smiles: CCCOc1ccc(cc1)N1C(=O)CC(C1=O)NC(c1ccccc1)C

STK542528
Synonyms: N- (2,4- dimethylphenyl)- 10- methyl- 11- (3- nitrophenyl)- 8- phenyl- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6- amine
Smiles: Cc1ccc(c(c1)C)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cccc(c1)[N+](=O)[O-])C)c1ccccc1

STK542529
Synonyms: 4- hydroxy- 2- oxo- 1- propyl- N- (pyridin- 3- yl)- 1,2,5,6,7,8- hexahydroquinoline- 3- carboxamide
Smiles: CCCn1c2CCCCc2c(c(c1=O)C(=O)Nc1cccnc1)O

STK542530
Synonyms: 2- [4- (4- methylbenzyl)piperazin- 1- yl]- N'- [(1E)- 1- (pyridin- 3- yl)ethylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)C)N/N=C(/c1cccnc1)\C

STK542531
Synonyms: N- (3- methylphenyl)- 2- {[3- (3- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCCC3

STK542532
Synonyms: (4- chlorophenyl)[3- (4- chlorophenyl)- 5- (furan- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]methanone
Smiles: Clc1ccc(cc1)C1=NN(C(C1)c1ccco1)C(=O)c1ccc(cc1)Cl

STK542533
Synonyms: 1- amino- N- (diphenylmethyl)- 8,8- dimethyl- 5- (morpholin- 4- yl)- 8,9- dihydro- 6H- pyrano[4,3- d]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCOCC1)NC(c1ccccc1)c1ccccc1

STK542534
Synonyms: (4- bromophenyl)[3- (4- bromophenyl)- 5- (furan- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]methanone
Smiles: Brc1ccc(cc1)C1=NN(C(C1)c1ccco1)C(=O)c1ccc(cc1)Br

STK542535
Synonyms: 3- (2- methoxybenzyl)- 11- (4- methoxybenzyl)- 2- methyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: COc1ccc(cc1)Cn1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)Cc1ccccc1OC

STK542537
Synonyms: N- benzyl- 2- {[3- (4- methylphenyl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3)NCc1ccccc1

STK542538
Synonyms: N,N- diethyl- 2- {[8- (3- methylphenyl)- 7- oxo- 5,6,7,8- tetrahydronaphtho[2',1':4,5]thieno[2,3- d]pyrimidin- 9- yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCc1c3cccc1)CC

STK542539
Synonyms: (4E)- 4- [(4- butoxy- 3- methylphenyl)(hydroxy)methylidene]- 5- (4- fluorophenyl)- 1- (pyridin- 3- ylmethyl)pyrrolidine- 2,3- dione
Smiles: CCCCOc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)F)Cc1cccnc1)/O

STK542540
Synonyms: 2,3,4,5- tetrafluoro- N'- [(8- methyl- 1,2,3a,4,5,6- hexahydro- 3H- pyrazino[3,2,1- jk]carbazol- 3- yl)acetyl]benzohydrazide
Smiles: O=C(CN1CCn2c3C1CCCc3c1c2ccc(c1)C)NNC(=O)c1cc(F)c(c(c1F)F)F

STK542541
Synonyms: (6aR,6bS,9aR,10S)- 8- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 10- [(3- nitrophenyl)carbonyl]- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: O=C([C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1c1ccccc1C=C2)c1ccc2c(c1)OCCO2)c1cccc(c1)[N+](=O)[O-]

STK542543
Synonyms: N,N- dibutyl- 2- {[5- oxo- 4- (2- phenylethyl)- 7- (propan- 2- yl)- 4,5,6,9- tetrahydro- 7H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CC(OC3)C(C)C)CCCC

STK542544
Synonyms: 6- {(2Z)- 2- [1- (naphthalen- 2- yl)ethylidene]hydrazinyl}[1,2,4]triazolo[4,3- b]pyridazine
Smiles: C/C(=N/Nc1ccc2n(n1)cnn2)/c1ccc2c(c1)cccc2

STK542545
Synonyms: N- (4- bromophenyl)- 2- {[3- cyano- 6- (3,4- dimethoxyphenyl)pyridin- 2- yl]sulfanyl}acetamide
Smiles: N#Cc1ccc(nc1SCC(=O)Nc1ccc(cc1)Br)c1ccc(c(c1)OC)OC

STK542546
Synonyms: N'~1~,N'~7~- bis[(E)- (2,4- dihydroxyphenyl)methylidene]heptanedihydrazide
Smiles: O=C(N/N=C/c1ccc(cc1O)O)CCCCCC(=O)N/N=C/c1ccc(cc1O)O

STK542547
Synonyms: methyl5- chloro- 3- [(2- {4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}propanoyl)amino]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(CC1)C/C=C/c1ccccc1)C)cc(cc2)Cl

STK542548
Synonyms: [3- (4- bromophenyl)- 5- (1- methyl- 1H- indol- 3- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl](phenyl)methanone
Smiles: Brc1ccc(cc1)C1=NN(C(C1)c1cn(c2c1cccc2)C)C(=O)c1ccccc1

STK542549
Synonyms: 3- (2,5- dibromophenyl)- 2- [(E)- 2- (2,4- dichlorophenyl)ethenyl]quinazolin- 4(3H)- one
Smiles: Clc1ccc(c(c1)Cl)/C=C/c1nc2ccccc2c(=O)n1c1cc(Br)ccc1Br

STK542550
Synonyms: 3- benzyl- 5- ethyl- 5- methyl- 2- (prop- 2- en- 1- ylsulfanyl)- 5,6- dihydrobenzo[h]quinazolin- 4(3H)- one
Smiles: C=CCSc1nc2c3ccccc3CC(c2c(=O)n1Cc1ccccc1)(C)CC

STK542554
Synonyms: 3,7- bis{[4- (propan- 2- yloxy)benzyl]sulfanyl}- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:4',3'- c]pyrimidine
Smiles: CC(Oc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c1n2c(SCc2ccc(cc2)OC(C)C)nn1)CCCC3)C

STK542555
Synonyms: (2Z)- 2- cyano- N- (2- methoxyphenyl)- 2- [5- (3- methylbenzyl)- 4- oxo- 3- phenyl- 1,3- thiazolidin- 2- ylidene]ethanamide
Smiles: N#C/C(=C\1/SC(C(=O)N1c1ccccc1)Cc1cccc(c1)C)/C(=O)Nc1ccccc1OC

STK542556
Synonyms: 8- fluoro- N- (4- fluorophenyl)- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indole- 2- carbothioamide
Smiles: Fc1ccc(cc1)NC(=S)N1CCc2c(C1)c1cc(F)ccc1[nH]2

STK542557
Synonyms: 2,2'- (10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:4',3'- c]pyrimidine- 3,7- diyldisulfanediyl)bis(N- phenylacetamide)
Smiles: O=C(Nc1ccccc1)CSc1nnc2n1c1sc3c(c1c1n2c(SCC(=O)Nc2ccccc2)nn1)CCCC3

STK542558
Synonyms: 2- amino- 1- (3,4- dimethoxyphenyl)- N- (2- methoxybenzyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COc1cc(ccc1OC)n1c2nc3ccccc3nc2c(c1N)C(=O)NCc1ccccc1OC

STK542559
Synonyms: 2- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 6,6- dimethyl- 3- (3- methylphenyl)- 3,5,6,8- tetrahydro- 4H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Cc1cccc(c1)n1c(SCC(=O)c2ccc(cc2)Cl)nc2c(c1=O)c1CC(C)(C)SCc1s2

STK542560
Synonyms: 2- ({5- [3- (1,3- dioxo- 1H- benzo[de]isoquinolin- 2(3H)- yl)propyl]- 4- phenyl- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (furan- 2- ylmethyl)acetamide
Smiles: O=C(NCc1ccco1)CSc1nnc(n1c1ccccc1)CCCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK542561
Synonyms: (4Z)- 4- (1- hydroxyethylidene)- 1- [3- (1H- imidazol- 1- yl)propyl]- 5- [4- (propan- 2- yl)phenyl]pyrrolidine- 2,3- dione
Smiles: CC(c1ccc(cc1)C1/C(=C(/O)\C)/C(=O)C(=O)N1CCCn1ccnc1)C

STK542564
Synonyms: 11- benzyl- 2- ethyl- 3- hexyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCCCn1c(CC)nc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccccc1

STK542565
Synonyms: [3- (4- chlorophenyl)- 5- (furan- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl](3,5- dinitrophenyl)methanone
Smiles: Clc1ccc(cc1)C1=NN(C(C1)c1ccco1)C(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]

STK542566
Synonyms: 6,6- dimethyl- 2- {[4- (propan- 2- yloxy)benzyl]sulfanyl}- 3- (prop- 2- en- 1- yl)- 3,5,6,8- tetrahydro- 4H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: C=CCn1c(SCc2ccc(cc2)OC(C)C)nc2c(c1=O)c1CC(C)(C)SCc1s2

STK542567
Synonyms: 4- chloro- N- [4- methyl- 2- (phenylcarbonyl)phenyl]benzenesulfonamide
Smiles: Cc1ccc(c(c1)C(=O)c1ccccc1)NS(=O)(=O)c1ccc(cc1)Cl

STK542569
Synonyms: (3aS,6aS)- 3- (4- bromophenyl)- 5- (4- methylphenyl)- 1- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C(=NN2c1ccccc1)c1ccc(cc1)Br

STK542571
Synonyms: N- (3- methoxyphenyl)- 2- [(4- oxo- 3- phenyl- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl)sulfanyl]acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCCC3

STK542572
Synonyms: N- {2- [(Z)- 2- (3- chlorophenyl)- 1- cyanoethenyl]- 4- (4- methylphenyl)- 1,3- thiazol- 5- yl}acetamide
Smiles: N#C/C(=C/c1cccc(c1)Cl)/c1sc(c(n1)c1ccc(cc1)C)NC(=O)C

STK542574
Synonyms: methyl7- (3- methylphenyl)- 6,8- dioxo- 1,2,7- triazaspiro[4.4]non- 2- ene- 3- carboxylate
Smiles: COC(=O)C1=NNC2(C1)CC(=O)N(C2=O)c1cccc(c1)C

STK542575
Synonyms: N- (diphenylmethyl)- 2- {[5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl]sulfanyl}acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK542576
Synonyms: 2- (3- chloro- 4- methylphenyl)- 9- (4- methoxyphenyl)tetrahydro- 5H- pyrazolo[1,2- a]pyrrolo[3,4- c]pyrazole- 1,3(2H,3aH)- dione
Smiles: COc1ccc(cc1)C1N2CCCN2C2C1C(=O)N(C2=O)c1ccc(c(c1)Cl)C

STK542577
Synonyms: 2- [4- (3- chlorophenyl)piperazin- 1- yl]- 1- (8- methyl- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)ethanone
Smiles: Clc1cccc(c1)N1CCN(CC1)CC(=O)N1CCc2c(C1)c1cc(C)ccc1[nH]2

STK542578
Synonyms: N- (4- bromophenyl)- 2- {[5- (morpholin- 4- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]thieno[2,3- c]isoquinolin- 8- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK542579
Synonyms: ethyl4- {2- amino- 3- [(4- ethoxyphenyl)carbamoyl]- 1H- pyrrolo[2,3- b]quinoxalin- 1- yl}benzoate
Smiles: CCOc1ccc(cc1)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)C(=O)OCC

STK542582
Synonyms: 3- benzyl- 2- (butylsulfanyl)- 6- iodoquinazolin- 4(3H)- one
Smiles: CCCCSc1nc2ccc(cc2c(=O)n1Cc1ccccc1)I

STK542584
Synonyms: ethyl4- [(4- amino- 6,7- dihydro- 5H- cyclopenta[4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]butanoate
Smiles: CCOC(=O)CCCSc1nc(N)c2c(n1)sc1c2CCC1

STK542585
Synonyms: N,N- dibutyl- 2- {[6,6- dimethyl- 4- oxo- 3- (2- phenylethyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CC(OC3)(C)C)CCCC

STK542586
Synonyms: (3aR,6aS)- 3- (4- nitrophenyl)- 5- [2- (trifluoromethyl)phenyl]- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: O=C1[C@H]2[C@@H](C(=O)N1c1ccccc1C(F)(F)F)ON=C2c1ccc(cc1)[N+](=O)[O-]

STK542587
Synonyms: ethylN- [6- (benzylamino)- 7- nitro- 2,1,3- benzoxadiazol- 4- yl]glycinate
Smiles: CCOC(=O)CNc1cc(NCc2ccccc2)c(c2c1non2)[N+](=O)[O-]

STK542588
Synonyms: diethyl[hydroxy(3,4,5- trimethoxyphenyl)methyl]phosphonate
Smiles: CCOP(=O)(C(c1cc(OC)c(c(c1)OC)OC)O)OCC

STK542589
Synonyms: (2E)- N- ({4- [(5- ethyl- 1,3,4- thiadiazol- 2- yl)sulfamoyl]phenyl}carbamothioyl)- 3- (4- methoxyphenyl)prop- 2- enamide
Smiles: CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)/C=C/c1ccc(cc1)OC

STK542590
Synonyms: 1- benzyl- 2- (4- bromophenyl)- 5,6- diphenyl- 1H- imidazo[1,2- a]imidazole
Smiles: Brc1ccc(cc1)c1cn2c(n1Cc1ccccc1)nc(c2c1ccccc1)c1ccccc1

STK542591
Synonyms: 3,7- bis[(3- nitrophenyl)acetyl]- 1,5- di(propan- 2- yl)- 3,7- diazabicyclo[3.3.1]nonan- 9- one
Smiles: O=C(N1CC2(CN(CC(C1)(C2=O)C(C)C)C(=O)Cc1cccc(c1)[N+](=O)[O-])C(C)C)Cc1cccc(c1)[N+](=O)[O-]

STK542594
Synonyms: (3aS,6aS)- 5- (4- fluorophenyl)- 3- (4- nitrophenyl)- 1- phenyl- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)N(N=C2c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK542595
Synonyms: N'- [(1E)- 1- (4- methoxyphenyl)propylidene]pyridine- 4- carbohydrazide
Smiles: CC/C(=N\NC(=O)c1ccncc1)/c1ccc(cc1)OC

STK542597
Synonyms: 3- (2,5- dibromophenyl)- 2- methylquinazolin- 4(3H)- one
Smiles: Brc1ccc(c(c1)n1c(C)nc2c(c1=O)cccc2)Br

STK542598
Synonyms: 2- {[4- amino- 6- (propan- 2- yl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}acetamide
Smiles: NC(=O)CSc1nc(N)c2c(n1)sc1c2CC(OC1)C(C)C

STK542599
Synonyms: N- (4- methylphenyl)- 2- {[3- (2- methylprop- 2- en- 1- yl)- 4- oxo- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3

STK542600
Synonyms: (5Z)- 1- (2,5- dimethoxyphenyl)- 5- [(1- methyl- 1H- pyrrol- 2- yl)methylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1N1C(=O)NC(=O)/C(=C/c2cccn2C)/C1=O)OC

STK542601
Synonyms: 4- chloro- N- {1- [1- (2- fluorobenzyl)- 1H- benzimidazol- 2- yl]ethyl}benzamide
Smiles: Clc1ccc(cc1)C(=O)NC(c1nc2c(n1Cc1ccccc1F)cccc2)C

STK542602
Synonyms: 2- {[6,6- dimethyl- 3- (4- methylphenyl)- 4- oxo- 3,5,6,8- tetrahydro- 4H- thiopyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- (3- methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(SC3)(C)C

STK542605
Synonyms: 3- bromo- N- (3- butoxyphenyl)- 2- oxo- 2H- pyran- 5- carboxamide
Smiles: CCCCOc1cccc(c1)NC(=O)c1coc(=O)c(c1)Br

STK542606
Synonyms: 9'- bromo- 2'- (naphthalen- 1- yl)- 4- phenyl- 1',10b'- dihydrospiro[cyclohexane- 1,5'- pyrazolo[1,5- c][1,3]benzoxazine]
Smiles: Brc1ccc2c(c1)C1CC(=NN1C1(O2)CCC(CC1)c1ccccc1)c1cccc2c1cccc2

STK542608
Synonyms: 3- benzyl- 11- (4- bromophenyl)- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: Brc1ccc(cc1)n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)Cc1ccccc1

STK542609
Synonyms: 2- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 6- iodo- 3- (3- methylphenyl)quinazolin- 4(3H)- one
Smiles: Cc1cccc(c1)n1c(SCC(=O)c2ccc(cc2)Cl)nc2c(c1=O)cc(cc2)I

STK542610
Synonyms: N'- [(E)- anthracen- 9- ylmethylidene]- 2- (1,3- benzoxazol- 2- ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1nc2c(o1)cccc2)N/N=C/c1c2ccccc2cc2c1cccc2

STK542613
Synonyms: (3aR,6aS)- 5- (4- fluorophenyl)- 3- (4- nitrophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: Fc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)ON=C2c1ccc(cc1)[N+](=O)[O-]

STK542614
Synonyms: 1- (4- chlorophenyl)- N,4- diphenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carbothioamide
Smiles: Clc1ccc(cc1)c1c2CCCCn3c2n(c1C(=S)Nc1ccccc1)cc3c1ccccc1

STK542615
Synonyms: N'- [(E)- (3,5- dichloro- 4- hydroxyphenyl)methylidene]- 2- [(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(s1)C)N/N=C/c1cc(Cl)c(c(c1)Cl)O

STK542616
Synonyms: 7- [(4- chlorobenzyl)oxy]- 3- ethyl- 4,8- dimethyl- 2H- chromen- 2- one
Smiles: CCc1c(=O)oc2c(c1C)ccc(c2C)OCc1ccc(cc1)Cl

STK542617
Synonyms: 2- {[4- oxo- 3- (2- phenylethyl)- 4,6- dihydro- 3H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 2- yl]sulfanyl}- N- phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3

STK542619
Synonyms: (2E)- 1- [5- (4- bromophenyl)- 3- phenyl- 4,5- dihydro- 1H- pyrazol- 1- yl]- 3- phenylprop- 2- en- 1- one
Smiles: Brc1ccc(cc1)C1CC(=NN1C(=O)/C=C/c1ccccc1)c1ccccc1

STK542620
Synonyms: 2- (4- chlorobenzyl)- 1- hydroxy- 3- methylpyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: N#Cc1c(C)c(Cc2ccc(cc2)Cl)c(n2c1nc1c2cccc1)O

STK542622
Synonyms: 2- ({5- [(2- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)- N'- [(E)- (2- methoxynaphthalen- 1- yl)methylidene]acetohydrazide
Smiles: COc1ccc2c(c1/C=N/NC(=O)CSc1nnc(s1)SCc1ccccc1Cl)cccc2

STK542623
Synonyms: 2- (4- nitrophenyl)- 1- [4- (trifluoromethyl)phenyl]- 1H- imidazo[4,5- b]quinoxaline
Smiles: [O-][N+](=O)c1ccc(cc1)c1nc2c(n1c1ccc(cc1)C(F)(F)F)nc1c(n2)cccc1

STK542624
Synonyms: (4E)- 4- [hydroxy(4- methoxyphenyl)methylidene]- 5- [4- (propan- 2- yl)phenyl]- 1- (pyridin- 4- ylmethyl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)Cc1ccncc1)/O

STK542625
Synonyms: 2- phenyl- 1- azaspiro[5.5]undecan- 4- ol
Smiles: OC1CC(NC2(C1)CCCCC2)c1ccccc1

STK542626
Synonyms: 7- benzyl- 2- {[2- (4- fluorophenyl)- 2- oxoethyl]sulfanyl}- 3- (3- methylphenyl)- 5,6,7,8- tetrahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: Cc1cccc(c1)n1c(SCC(=O)c2ccc(cc2)F)nc2c(c1=O)c1CCN(Cc1s2)Cc1ccccc1

STK542627
Synonyms: 2- [4- (4- chlorobenzyl)piperazin- 1- yl]- N'- [(E)- (3- phenoxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CN1CCN(CC1)Cc1ccc(cc1)Cl)N/N=C/c1cccc(c1)Oc1ccccc1

STK542629
Synonyms: (4E)- 5- (4- ethoxy- 3- methoxyphenyl)- 4- [hydroxy(4- methoxy- 3- methylphenyl)methylidene]- 1- (3- methoxypropyl)pyrrolidine- 2,3- dione
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)C)OC)/O)/C1c1ccc(c(c1)OC)OCC

STK542630
Synonyms: (4E)- 4- [hydroxy(4- methoxy- 2- methylphenyl)methylidene]- 5- (pyridin- 4- yl)- 1- (pyridin- 3- ylmethyl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(c(c1)C)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)Cc1cccnc1)/O

STK542631
Synonyms: 2- phenyl- 6,7,8,9- tetrahydrothieno[3',2':4,5]pyrimido[1,2- a]azepin- 11(5H)- one
Smiles: O=c1n2CCCCCc2nc2c1sc(c2)c1ccccc1

STK542633
Synonyms: N'- [(E)- (4- propoxyphenyl)methylidene]pyrazine- 2- carbohydrazide
Smiles: CCCOc1ccc(cc1)/C=N/NC(=O)c1nccnc1

STK542634
Synonyms: 2- [(3- cyclohexyl- 4- oxo- 3,4,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl)sulfanyl]- N,N- diphenylacetamide
Smiles: O=C(N(c1ccccc1)c1ccccc1)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCCC3

STK542635
Synonyms: 3- {(Z)- [3- (2- chlorobenzyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- {[2- (2- hydroxyethoxy)ethyl]amino}- 9- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: OCCOCCNc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccccc1Cl

STK542638
Synonyms: 2- [(3,4- dichlorobenzyl)sulfanyl]- 3- (2- phenylethyl)- 6- (propan- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)CCc1ccccc1)SCc1ccc(c(c1)Cl)Cl)C

STK542639
Synonyms: 6- chloro- 2- [5- (furan- 2- yl)- 3- (4- methylphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- phenylquinazoline
Smiles: Cc1ccc(cc1)C1=NN(C(C1)c1ccco1)c1nc2ccc(cc2c(n1)c1ccccc1)Cl

STK542640
Synonyms: N- (diphenylmethyl)- 2- [(3,6,6- trimethyl- 4- oxo- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl)sulfanyl]acetamide
Smiles: O=C(NC(c1ccccc1)c1ccccc1)CSc1nc2sc3c(c2c(=O)n1C)CC(OC3)(C)C

STK542641
Synonyms: 1- ethyl- 6- fluoro- 7- {4- [(4- methylphenyl)carbamothioyl]piperazin- 1- yl}- 4- oxo- 1,4- dihydroquinoline- 3- carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=S)Nc1ccc(cc1)C)c(c2)F

STK542642
Synonyms: 6- iodo- 3- (4- methylphenyl)- 2- (propylsulfanyl)quinazolin- 4(3H)- one
Smiles: CCCSc1nc2ccc(cc2c(=O)n1c1ccc(cc1)C)I

STK542643
Synonyms: 3- {(Z)- [3- (4- fluorobenzyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- [4- (2- hydroxyethyl)piperazin- 1- yl]- 9- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: OCCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)F

STK542644
Synonyms: (3aR,6aS)- 3- (4- bromophenyl)- 5- (naphthalen- 1- yl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: Brc1ccc(cc1)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1cccc2c1cccc2

STK542645
Synonyms: (4E)- 5- (4- fluorophenyl)- 4- [hydroxy(4- methoxyphenyl)methylidene]- 1- (pyrimidin- 2- yl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)F)c1ncccn1)/O

STK542648
Synonyms: 2- {[5- (3,4- dimethoxyphenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N'- [(Z)- (3- phenoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(ccc1OC)c1nnc(n1CC)SCC(=O)N/N=C\c1cccc(c1)Oc1ccccc1

STK542650
Synonyms: (6aR,6bS,9aR,10S)- 8- (3- fluorophenyl)- 10- [(4- methoxyphenyl)carbonyl]- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1cccc(c1)F)C=Cc1c2cccc1

STK542651
Synonyms: (5Z)- 5- {3- bromo- 4- [2- (4- cyclohexylphenoxy)ethoxy]- 5- methoxybenzylidene}- 2- imino- 1,3- thiazolidin- 4- one
Smiles: COc1cc(/C=C/2\SC(=N)NC2=O)cc(c1OCCOc1ccc(cc1)C1CCCCC1)Br

STK542652
Synonyms: N- benzyl- 1- (4- bromophenyl)- 2- {[(4- methylphenyl)sulfonyl]amino}- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: Brc1ccc(cc1)n1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)C)C(=O)NCc1ccccc1

STK542653
Synonyms: 2- (4- chloro- 3- fluorophenyl)- 9- (4- methoxyphenyl)tetrahydro- 5H- pyrazolo[1,2- a]pyrrolo[3,4- c]pyrazole- 1,3(2H,3aH)- dione
Smiles: COc1ccc(cc1)C1N2CCCN2C2C1C(=O)N(C2=O)c1ccc(c(c1)F)Cl

STK542654
Synonyms: 2- {[5- (ethoxycarbonyl)- 5- methyl- 2- oxo- 1- phenyl- 2,5- dihydro- 1H- pyrrol- 3- yl]amino}benzoicacid
Smiles: CCOC(=O)C1(C)C=C(C(=O)N1c1ccccc1)Nc1ccccc1C(=O)O

STK542655
Synonyms: (2- chlorophenyl)[3- (4- chlorophenyl)- 5- (furan- 2- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]methanone
Smiles: Clc1ccc(cc1)C1=NN(C(C1)c1ccco1)C(=O)c1ccccc1Cl