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

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STK593492
Synonyms: 2- (6- fluoro- 1,3- benzothiazol- 2- yl)- 1- phenyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Fc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccccc1)c(=O)c1c(o2)cccc1

STK593493
Synonyms: 7- chloro- 1- (2- methoxyphenyl)- 6- methyl- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccccc1C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK593494
Synonyms: 2,12,12- trimethyl- 7- [(2- phenylethyl)sulfanyl]- 12,13- dihydro- 10H- pyrano[4',3':4,5]thieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidine
Smiles: Cc1nn2c(n1)c1c3CC(C)(C)OCc3sc1n1c2nnc1SCCc1ccccc1

STK593495
Synonyms: N- (2,5- dimethylphenyl)- 2- {[4- (4- methylphenyl)- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(C)ccc1C)CSc1nnc(n1c1ccc(cc1)C)c1nccnc1

STK593496
Synonyms: 1- (4- methoxyphenyl)- 5- oxo- N- {(2S)- 1- oxo- 1- [(2- phenylethyl)amino]propan- 2- yl}pyrrolidine- 3- carboxamide
Smiles: COc1ccc(cc1)N1CC(CC1=O)C(=O)N[C@H](C(=O)NCCc1ccccc1)C

STK593497
Synonyms: 4- [({[4- (4- chlorophenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK593499
Synonyms: 4- bromo- N'- [(E)- (5- methoxy- 1H- indol- 3- yl)methylidene]benzohydrazide
Smiles: COc1ccc2c(c1)c(/C=N/NC(=O)c1ccc(cc1)Br)c[nH]2

STK593501
Synonyms: 6- amino- 1- (4- chlorophenyl)- 4- (4- hydroxy- 3- methoxyphenyl)- 3- methyl- 1H- pyrazolo[3,4- b]pyridine- 5- carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccc(c(c1)OC)O)c(C)nn2c1ccc(cc1)Cl

STK593502
Synonyms: 8- (benzylamino)- 6- hydroxy- 3- methyl- 7- (3- methylbenzyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: Cc1cccc(c1)Cn1c(NCc2ccccc2)nc2c1c(O)nc(=O)n2C

STK593503
Synonyms: N- [5- hydroxy- 2- (4- methoxyphenyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]cyclohexanecarboxamide
Smiles: COc1ccc(cc1)c1nn2c(n1)nc(cc2NC(=O)C1CCCCC1)O

STK593504
Synonyms: 6- chloro- 2- oxo- 4- propyl- 2H- chromen- 7- yl2- {[(benzyloxy)carbonyl]amino}butanoate
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)C(NC(=O)OCc1ccccc1)CC

STK593505
Synonyms: 5- (2,4- dichlorophenyl)- 4- ({(E)- [4- (propan- 2- yl)phenyl]methylidene}amino)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccc(c(c1)Cl)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(C)C

STK593507
Synonyms: 3- (2- phenylethyl)- 1- [2- (piperidin- 1- yl)ethyl]- 1,5,6,7,8,9- hexahydro- 2H- cyclohepta[4,5]thieno[2,3- d]pyrimidine- 2,4(3H)- dione
Smiles: O=c1n(CCc2ccccc2)c(=O)c2c(n1CCN1CCCCC1)sc1c2CCCCC1

STK593508
Synonyms: (5E)- 6- hydroxy- 3- (2- methylphenyl)- 5- ({[2- (pyridin- 3- yl)piperidin- 1- yl]amino}methylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C/NN1CCCCC1c1cccnc1)c1ccccc1C

STK593509
Synonyms: 4- [7- (2- chlorophenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]phenol
Smiles: Oc1ccc(cc1)c1nn2c(n1)c1cnn(c1nc2)c1ccccc1Cl

STK593511
Synonyms: 4- {[(E)- (3,5- dimethyl- 1- phenyl- 1H- pyrazol- 4- yl)methylidene]amino}- 5- phenyl- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1nn(c(c1/C=N/n1c(=S)[nH]nc1c1ccccc1)C)c1ccccc1

STK593512
Synonyms: (E)- N- [(10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)methoxy]- 1- phenylmethanimine
Smiles: CC1(C)OCc2c(C1)c1c(s2)ncn2c1nc(n2)CO/N=C/c1ccccc1

STK593513
Synonyms: 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- yl{[(benzyloxy)carbonyl]amino}(phenyl)acetate
Smiles: O=C(NC(C(=O)Oc1ccc2c(c1)oc(=O)c1c2CCC1)c1ccccc1)OCc1ccccc1

STK593514
Synonyms: 2- (4- benzylpiperazin- 1- yl)- 6- {[(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]methyl}pyrimidin- 4- ol
Smiles: Oc1cc(CSc2nnnn2c2ccccc2)nc(n1)N1CCN(CC1)Cc1ccccc1

STK593516
Synonyms: 2- [(6- chloro- 4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 4- ylmethyl)acetamide
Smiles: O=C(COc1cc2oc(=O)cc(c2cc1Cl)C)NCc1ccncc1

STK593517
Synonyms: (3R)- N- [2- (4- chlorophenyl)ethyl]- 2,2- dimethyl- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: Clc1ccc(cc1)CCNC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1

STK593520
Synonyms: 3- benzyl- 2- [(pyridin- 3- ylmethyl)amino]- 3,5,6,7,8,9- hexahydro- 4H- cyclohepta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: O=c1c2c(sc3c2CCCCC3)nc(n1Cc1ccccc1)NCc1cccnc1

STK593521
Synonyms: 2- [(4- chlorobenzyl)sulfanyl]- 5- hydroxy- 4- (4- methylphenyl)- 4,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(SCc2ccc(cc2)Cl)N=C2C(=C(O)CCC2)C1c1ccc(cc1)C

STK593523
Synonyms: 4- {[(E)- anthracen- 9- ylmethylidene]amino}- 5- (2- chlorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccccc1c1n[nH]c(=S)n1/N=C/c1c2ccccc2cc2c1cccc2

STK593524
Synonyms: 1- ethyl- 5- methoxy- 2- methyl- N- (pyridin- 2- ylmethyl)- 1H- indole- 3- carboxamide
Smiles: COc1ccc2c(c1)c(C(=O)NCc1ccccn1)c(n2CC)C

STK593525
Synonyms: 1- [5- chloro- 4- (methylamino)- 6- oxopyridazin- 1(6H)- yl]tricyclo[3.3.1.1~3,7~]decane- 2- carboxylicacid
Smiles: CNc1cnn(c(=O)c1Cl)C12CC3CC(C1)CC(C2C(=O)O)C3

STK593526
Synonyms: (4E)- 1- (5- bromopyridin- 2- yl)- 4- [hydroxy(phenyl)methylidene]- 5- (4- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: Brc1ccc(nc1)N1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(cc1)[N+](=O)[O-]

STK593528
Synonyms: (2,6- difluorophenyl)(6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1c(F)cccc1F

STK593529
Synonyms: ethyl[3- (2- methoxyphenyl)- 1',3'- dimethyl- 2',4',6'- trioxo- 1',2,3,3',4,4',4a,6'- octahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidin]- 8- yl]carbamate
Smiles: CCOC(=O)Nc1ccc2c(c1)CC1(C3N2CCN(C3)c2ccccc2OC)C(=O)N(C)C(=O)N(C1=O)C

STK593530
Synonyms: 2- [(4- benzylpiperidin- 1- yl)carbonyl]- 1- (3- methoxypropyl)- 9- methylpyrido[1,2- a]pyrrolo[2,3- d]pyrimidin- 4(1H)- one
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)N1CCC(CC1)Cc1ccccc1

STK593531
Synonyms: N- (3,5- dimethylphenyl)- 2- (7- methyl- 3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)acetamide
Smiles: O=C(Nc1cc(C)cc(c1)C)CN1CCc2c(C1C)cc1c(c2)OCCCO1

STK593532
Synonyms: (3a'S,6a'R)- 5'- (butan- 2- yl)- 3'- (2- methylpropyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(C)C)C(=O)Nc2c1cccc2)C

STK593534
Synonyms: 2- [(2- fluorobenzyl)sulfanyl]- 6,6- dimethyl- 3- (4- methylphenyl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Cc1ccc(cc1)n1c(SCc2ccccc2F)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK593537
Synonyms: 7'- {[(E)- (1- tert- butyl- 2- hydroxy- 4,6- dioxo- 1,6- dihydropyrimidin- 5(4H)- ylidene)methyl]amino}- 1,3- dimethyl- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- trio
Smiles: O=C1N=C(O)N(C(=O)/C/1=C/Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C)C(C)(C)C

STK593538
Synonyms: 1- (4- ethoxyphenyl)- 2- (6- fluoro- 1,3- benzothiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1ccc(cc1)C1N(c2sc3c(n2)ccc(c3)F)C(=O)c2c1c(=O)c1c(o2)cccc1

STK593539
Synonyms: methyl4- [7- chloro- 3,9- dioxo- 2- (pyridin- 3- ylmethyl)- 1,2,3,9- tetrahydrochromeno[2,3- c]pyrrol- 1- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK593540
Synonyms: (3a'S,6a'R)- 5'- cyclopentyl- 3'- (3,4- dihydroxybenzyl)- 5- fluoro- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C1CCCC1)Cc1ccc(c(c1)O)O)C(=O)N2

STK593541
Synonyms: N- [2- chloro- 5- (trifluoromethyl)phenyl]- 3- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanamide
Smiles: O=C(Nc1cc(ccc1Cl)C(F)(F)F)CCn1nnc2c(c1=O)cccc2

STK593543
Synonyms: 2- [(4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 2- ylmethyl)acetamide
Smiles: O=C(NCc1ccccn1)COc1ccc2c(c1)oc(=O)cc2C

STK593547
Synonyms: 6,8- dibromo- N- hexyl- 2,4- dihydroxyquinoline- 3- carboxamide
Smiles: CCCCCCNC(=O)c1c(O)nc2c(c1O)cc(cc2Br)Br

STK593549
Synonyms: 4- (4- chlorophenyl)- N- cyclohexyl- 1- (4- ethoxyphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCOc1ccc(cc1)c1c(C(=O)NC2CCCCC2)n2c3c1CCCCn3c(c2)c1ccc(cc1)Cl

STK593550
Synonyms: 8- (4- ethoxyphenyl)- 1- methyl- 3- (2- phenylethyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STK593553
Synonyms: 6- hydroxy- 7- [2- hydroxy- 3- (naphthalen- 2- yloxy)propyl]- 8- [4- (4- methoxyphenyl)piperazin- 1- yl]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: COc1ccc(cc1)N1CCN(CC1)c1nc2c(n1CC(COc1ccc3c(c1)cccc3)O)c(O)nc(=O)n2C

STK593554
Synonyms: N- (4- butoxyphenyl)- 4- (4- oxoquinazolin- 3(4H)- yl)butanamide
Smiles: CCCCOc1ccc(cc1)NC(=O)CCCn1cnc2c(c1=O)cccc2

STK593555
Synonyms: 5- (thiophen- 2- yl)- 1,3,4- thiadiazole- 2- thiol
Smiles: Sc1nnc(s1)c1cccs1

STK593556
Synonyms: 4- (4- methoxyphenyl)- 3- (3- methylphenyl)- 5- {[3- (trifluoromethyl)benzyl]sulfanyl}- 4H- 1,2,4- triazole
Smiles: COc1ccc(cc1)n1c(SCc2cccc(c2)C(F)(F)F)nnc1c1cccc(c1)C

STK593559
Synonyms: (3a'S,6a'R)- 5'- [2- (3,4- dimethoxyphenyl)ethyl]- 5- fluoro- 3'- (2- methylpropyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(NC3CC(C)C)C(=O)Nc3c2cc(F)cc3)ccc1OC

STK593560
Synonyms: 4- hydroxy- 2- (methylsulfanyl)- 5- (2,4,5- trimethoxyphenyl)- 5,8- dihydropyrido[2,3- d]pyrimidin- 7(6H)- one
Smiles: CSc1nc(O)c2c(n1)NC(=O)CC2c1cc(OC)c(cc1OC)OC

STK593562
Synonyms: 2,2,5- trimethyl- 8- (4- methylpiperidin- 1- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: CC1CCN(CC1)c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C

STK593563
Synonyms: N- (4- ethoxyphenyl)- 2- ({5- [(4- methylphenoxy)methyl]- 4- phenyl- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)COc1ccc(cc1)C

STK593564
Synonyms: 9- (2,5- dimethoxyphenyl)- 2- (ethylsulfanyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CCSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1cc(OC)ccc1OC

STK593565
Synonyms: (2- benzyl- 4- hydroxy- 1,1- dioxido- 2H- 1,2- benzothiazin- 3- yl)(morpholin- 4- yl)methanone
Smiles: O=C(C1=C(O)c2ccccc2S(=O)(=O)N1Cc1ccccc1)N1CCOCC1

STK593567
Synonyms: 2- (4,6- dimethyl- 1,3- benzothiazol- 2- yl)- 1- (4- ethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1ccc(cc1)C1N(c2sc3c(n2)c(C)cc(c3)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK593568
Synonyms: 5- (4- ethoxyphenyl)- 4- [(2E)- 2- (pyridin- 3- ylmethylidene)hydrazinyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1N/N=C/c1cccnc1

STK593569
Synonyms: N- (2- chlorophenyl)- 4- (4- methylphenyl)- 1- phenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: Cc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1ccccc1Cl)c1ccccc1

STK593570
Synonyms: (1'S,3R,3'S,7a'R)- 5'',7''- dimethyl- 1'- [(4- propoxyphenyl)carbonyl]- 5',6',7',7a'- tetrahydro- 1'H- dispiro[indole- 3,2'- pyrrolizine- 3',3''- indole]- 2,2''(1H,1''H)- dione
Smiles: CCCOc1ccc(cc1)C(=O)[C@@H]1[C@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(C)cc1C

STK593571
Synonyms: 2- {[5- (2- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,5- dimethylphenyl)acetamide
Smiles: O=C(Nc1cc(C)ccc1C)CSc1nnc(n1Cc1ccco1)c1ccccc1Cl

STK593572
Synonyms: (4E)- 5- [4- (dimethylamino)phenyl]- 1- hexyl- 4- [hydroxy(4- methylphenyl)methylidene]pyrrolidine- 2,3- dione
Smiles: CCCCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccc(cc1)N(C)C

STK593576
Synonyms: 1- (4- ethoxy- 3- methoxyphenyl)- 7- fluoro- 2- (6- methylpyridin- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1ccc(cc1OC)C1N(c2cccc(n2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK593577
Synonyms: (4E)- 2- (2- ethylphenyl)- 4- {[(2- hydroxyethyl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: OCCN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccccc1CC

STK593578
Synonyms: 2- [(8- benzyl- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- yl)amino]butan- 1- ol
Smiles: CCC(Nc1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1)CO

STK593579
Synonyms: 2- {[4- (4- methoxyphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4,6- trimethylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2C)C)nnc1Cc1cccs1

STK593580
Synonyms: 8- [4- (4- fluorobenzyl)piperazin- 1- yl]- 6- hydroxy- 3- methyl- 7- (2- methylprop- 2- en- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: Fc1ccc(cc1)CN1CCN(CC1)c1nc2c(n1CC(=C)C)c(O)nc(=O)n2C

STK593581
Synonyms: 6- (3- chlorophenyl)- 9- (4- hydroxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Oc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1cccc(c1)Cl

STK593583
Synonyms: 4- methyl- 6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 3- yl6- [(tert- butoxycarbonyl)amino]hexanoate
Smiles: O=C(Oc1ccc2c(c1C)oc(=O)c1c2CCCC1)CCCCCNC(=O)OC(C)(C)C

STK593584
Synonyms: 4- (3- chlorophenyl)- 8- methyl- 1- [(3- methylbutyl)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(CCSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)Cl)CCN(C3)C)C

STK593585
Synonyms: (3a'S,6a'R)- 5- bromo- 5'- tert- butyl- 3'- (propan- 2- yl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: Brc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C(C)(C)C)C(C)C)C(=O)N2

STK593587
Synonyms: (E)- {1- [3- (diethylammonio)propyl]- 2- (2,5- dimethoxyphenyl)- 4,5- dioxopyrrolidin- 3- ylidene}[3- fluoro- 4- (propan- 2- yloxy)phenyl]methanolate
Smiles: CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)F)OC(C)C)/[O-])/C1c1cc(OC)ccc1OC)CC

STK593588
Synonyms: 3,6- diamino- 5- cyano- N- {2- [(4- fluorobenzyl)sulfanyl]phenyl}thieno[2,3- b]pyridine- 2- carboxamide
Smiles: N#Cc1cc2c(nc1N)sc(c2N)C(=O)Nc1ccccc1SCc1ccc(cc1)F

STK593589
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(2- chlorophenyl)carbonyl]- 3'- [(4- fluorophenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Fc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1Cl)C(=O)Nc1c2cccc1)cccc3

STK593590
Synonyms: [(4Z)- 4- (hydroxyimino)- 3,6,6- trimethyl- 4,5,6,7- tetrahydro- 1- benzofuran- 2- yl](4- phenylpiperazin- 1- yl)methanone
Smiles: O/N=C\1/CC(C)(C)Cc2c1c(C)c(o2)C(=O)N1CCN(CC1)c1ccccc1

STK593591
Synonyms: N- (2- tert- butylphenyl)- 2- {[5- (4- fluorophenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2C(C)(C)C)nnc1c1ccc(cc1)F

STK593592
Synonyms: 2- [4- (4- methoxyphenyl)piperazin- 1- yl]- N- [(2Z)- 4- (4- methylphenyl)- 1,3- thiazol- 2(3H)- ylidene]acetamide
Smiles: COc1ccc(cc1)N1CCN(CC1)CC(=O)/N=c/1\scc([nH]1)c1ccc(cc1)C

STK593593
Synonyms: 2- (6- fluoro- 1,3- benzothiazol- 2- yl)- 1- [4- (prop- 2- en- 1- yloxy)phenyl]- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: C=CCOc1ccc(cc1)C1N(c2sc3c(n2)ccc(c3)F)C(=O)c2c1c(=O)c1c(o2)cccc1

STK593595
Synonyms: 1- [1- hydroxy- 11- (4- methoxyphenyl)- 3- methyl- 2,3,4,11- tetrahydro- 10H- dibenzo[b,e][1,4]diazepin- 10- yl]- 2- phenoxyethanone
Smiles: COc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)COc1ccccc1)cccc2)C

STK593596
Synonyms: ethyl4- oxo- 2- (2- oxo- 2- phenylethyl)- 4- phenylbutanoate
Smiles: CCOC(=O)C(CC(=O)c1ccccc1)CC(=O)c1ccccc1

STK593597
Synonyms: N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (2- methylpropyl)thiophene- 2- carboxamide
Smiles: CC(CN(C(=O)c1cccs1)Cc1cc2ccc(cc2[nH]c1=O)C)C

STK593598
Synonyms: N- [(2Z)- 3- (5- chloro- 2- methoxyphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]cyclopropanecarboxamide
Smiles: COc1ccc(cc1N1/C(=N/C(=O)C2CC2)/SC2C1CS(=O)(=O)C2)Cl

STK593601
Synonyms: ethyl2- {[(Z)- (6- hydroxy- 4- oxo- 2- sulfanylpyrimidin- 5(4H)- ylidene)methyl]amino}- 5- methylthiophene- 3- carboxylate
Smiles: CCOC(=O)c1cc(sc1N/C=C\1/C(=NC(=NC1=O)S)O)C

STK593602
Synonyms: 5- propyl- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinolin- 8- ol
Smiles: CCCc1nc2oc3c(c2c2c1CCCC2)ncnc3O

STK593603
Synonyms: 1- benzyl- 6- cyclohexyl- 2- hydroxy- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(O)n(c2c1CN(CN2)C1CCCCC1)Cc1ccccc1

STK593604
Synonyms: 4- (9,10- dimethoxy- 3,3- dimethyl- 1- oxo- 2,3,4,6,7,13- hexahydro- 1H- isoquino[2,1- a]quinolin- 13- yl)- 1,5- dimethyl- 1H- pyrrole- 2- carbonitrile
Smiles: COc1cc2CCN3C(=CC(C4=C3CC(C)(C)CC4=O)c3cc(n(c3C)C)C#N)c2cc1OC

STK593606
Synonyms: 2- {[3- cyano- 4- (furan- 2- yl)- 5- hydroxy- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- (2,4- dimethoxyphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2OC)OC)N=C2C(=C(O)CCC2)C1c1ccco1

STK593608
Synonyms: 4- tert- butyl- N- {1- methyl- 4- oxo- 3- [3- (trifluoromethyl)phenyl]- 1,4- dihydroquinolin- 2- yl}benzamide
Smiles: O=C(c1ccc(cc1)C(C)(C)C)Nc1n(C)c2ccccc2c(=O)c1c1cccc(c1)C(F)(F)F

STK593609
Synonyms: methyl(8- {[4- (4- methoxyphenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl)acetate
Smiles: COC(=O)Cn1c(CN2CCN(CC2)c2ccc(cc2)OC)nc2c1c(=O)n(c(=O)n2C)C

STK593611
Synonyms: (1Z)- 1- {(2Z)- [4- (4- methylphenyl)- 1,3- thiazol- 2(3H)- ylidene]hydrazinylidene}- 1H- isoindol- 3- amine
Smiles: Cc1ccc(cc1)c1cs/c(=N\N=C\2/N=C(c3c2cccc3)N)/[nH]1

STK593612
Synonyms: 4- methoxy- N- [(3E)- 7- methyl- 1- propyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]benzenesulfonamide
Smiles: CCCn1[nH]/c(=N/S(=O)(=O)c2ccc(cc2)OC)/c2c1nc1cc(C)ccc1c2

STK593614
Synonyms: 2,2'- {[(10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)methyl]imino}diethanol
Smiles: OCCN(Cc1nc2n(n1)cnc1c2c2CC(C)(C)OCc2s1)CCO

STK593615
Synonyms: 2- {[3- cyano- 4- (furan- 2- yl)- 5- hydroxy- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: N#CC1=C(SCC(=O)N(c2ccccc2)c2ccccc2)N=C2C(=C(O)CCC2)C1c1ccco1

STK593616
Synonyms: 2- [10- (4- methoxyphenyl)- 2,6,8- trioxo- 3,4a,5,5a,6,8,8a,9,9a,10- decahydro- 5,9- methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3- f]isoindol- 7(2H)- yl]propanoicacid
Smiles: COc1ccc(cc1)C1C2C(Sc3c1sc(=O)[nH]3)C1CC2C2C1C(=O)N(C2=O)C(C(=O)O)C

STK593617
Synonyms: N- [(3E)- 1- ethyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 4- methoxybenzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c\1/[nH]n(c2c1cc1ccccc1n2)CC

STK593618
Synonyms: (4E)- 5- (4- bromophenyl)- 1- (furan- 2- ylmethyl)- 4- [hydroxy(3- nitrophenyl)methylidene]pyrrolidine- 2,3- dione
Smiles: Brc1ccc(cc1)C1/C(=C(/c2cccc(c2)[N+](=O)[O-])\O)/C(=O)C(=O)N1Cc1ccco1

STK593619
Synonyms: 5- (4- fluorophenyl)- 4- {[(E)- (3- methoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)F

STK593620
Synonyms: N- (5- chloro- 2- methylphenyl)- 2- ({5- [(4- methylphenoxy)methyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: O=C(Nc1cc(Cl)ccc1C)CSc1nnc(n1c1ccc(cc1)C)COc1ccc(cc1)C

STK593623
Synonyms: 4- methyl- N'- [(E)- quinoxalin- 6- ylmethylidene]benzenesulfonohydrazide
Smiles: Cc1ccc(cc1)S(=O)(=O)N/N=C/c1ccc2c(c1)nccn2

STK593627
Synonyms: 8- bromo- 7- {3- [(4,6- dimethylpyrimidin- 2- yl)sulfanyl]- 2- methylpropyl}- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(Cn1c(Br)nc2c1c(O)nc(=O)n2C)CSc1nc(C)cc(n1)C

STK593629
Synonyms: N~5~,N~5~- diethyl- 2,1,3- benzoxadiazole- 4,5- diamine
Smiles: CCN(c1ccc2c(c1N)non2)CC

STK593632
Synonyms: 13- (2- bromophenyl)- 9,10- dimethoxy- 3,3- dimethyl- 2,3,4,6,7,13- hexahydro- 1H- isoquino[2,1- a]quinolin- 1- one
Smiles: COc1cc2c(cc1OC)CCN1C2=CC(C2=C1CC(CC2=O)(C)C)c1ccccc1Br

STK593634
Synonyms: N- (4- {[(4E)- 6- bromo- 2- (4- methoxyphenyl)- 4H- chromen- 4- ylidene]amino}phenyl)acetamide
Smiles: COc1ccc(cc1)c1c/c(=N\c2ccc(cc2)NC(=O)C)/c2c(o1)ccc(c2)Br

STK593635
Synonyms: 13- (8- bromo- 2,3- dihydro- 1,4- benzodioxin- 6- yl)- 9,10- dimethoxy- 3,3- dimethyl- 2,3,4,6,7,13- hexahydro- 1H- isoquino[2,1- a]quinolin- 1- one
Smiles: COc1cc2CCN3C(=CC(C4=C3CC(C)(C)CC4=O)c3cc(Br)c4c(c3)OCCO4)c2cc1OC

STK593637
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(2- chlorophenyl)carbonyl]- 2'- (furan- 2- ylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Clc1ccccc1C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccco1)C(=O)Nc1c2cccc1)cccc3

STK593639
Synonyms: N- (3- chloro- 2- methylphenyl)- 2- {[4- (4- methoxyphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2C)Cl)nnc1c1ccccn1

STK593640
Synonyms: 3- fluoro- N- {[(2Z)- 4- (3- nitrophenyl)- 1,3- thiazol- 2(3H)- ylidene]carbamothioyl}benzamide
Smiles: Fc1cccc(c1)C(=O)NC(=S)/N=c/1\scc([nH]1)c1cccc(c1)[N+](=O)[O-]

STK593642
Synonyms: N- butyl- 5,7- dimethyl- N- (thiophen- 2- ylmethyl)[1,2,4]triazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: CCCCN(C(=O)c1nn2c(n1)nc(cc2C)C)Cc1cccs1

STK593643
Synonyms: N- [(2Z)- 3- (3,4- dimethoxybenzyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]cyclopropanecarboxamide
Smiles: COc1cc(ccc1OC)CN1/C(=N/C(=O)C2CC2)/SC2C1CS(=O)(=O)C2

STK593645
Synonyms: (5E)- 3- cyclohexyl- 6- hydroxy- 5- {1- [(3- hydroxypropyl)amino]propylidene}pyrimidine- 2,4(3H,5H)- dione
Smiles: OCCCN/C(=C/1\C(=NC(=O)N(C1=O)C1CCCCC1)O)/CC

STK593647
Synonyms: 2- hydroxy- N'- [(E)- quinolin- 4- ylmethylidene]benzohydrazide
Smiles: O=C(c1ccccc1O)N/N=C/c1ccnc2c1cccc2

STK593649
Synonyms: 4- methoxy- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (pyridin- 3- ylmethyl)benzamide
Smiles: COc1ccc(cc1)C(=O)N(Cc1cc2cc(C)ccc2[nH]c1=O)Cc1cccnc1

STK593650
Synonyms: (3a'S,6a'R)- 5'- butyl- 5- chloro- 3'- (4- hydroxybenzyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cc(Cl)cc2

STK593652
Synonyms: 4,5,6- trimethoxy- N'- [(E)- (4- methoxyphenyl)methylidene]- 1H- indole- 2- carbohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)c1cc2c([nH]1)cc(c(c2OC)OC)OC

STK593654
Synonyms: 2- (2- methoxy- 5- {(E)- [1- (3- methylphenyl)- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}benzyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1)C)S

STK593656
Synonyms: N- [(2Z)- 3- (4- methoxybenzyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- methylpropanamide
Smiles: COc1ccc(cc1)CN1/C(=N/C(=O)C(C)C)/SC2C1CS(=O)(=O)C2

STK593658
Synonyms: (4Z)- 4- [2- (1,3- benzodioxol- 5- yl)- 4H- chromen- 4- ylidene]- 2- (2- chlorophenyl)- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C\1/C=C(Oc2c1cccc2)c1ccc2c(c1)OCO2)c1ccccc1Cl

STK593659
Synonyms: 3- [(3- bromobenzyl)oxy]- 1- hydroxy- 5- methyl- 9H- xanthen- 9- one
Smiles: Brc1cccc(c1)COc1cc(O)c2c(c1)oc1c(c2=O)cccc1C

STK593661
Synonyms: N- (3- chloro- 2- methylphenyl)- 6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinoline- 2(1H)- carbothioamide
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=S)Nc1cccc(c1C)Cl

STK593662
Synonyms: 2- (4- nitrophenyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: [O-][N+](=O)c1ccc(cc1)c1nn2c(n1)c1c(nc2)sc2c1CCCC2

STK593664
Synonyms: 7- butyl- 1,3- dimethyl- 8- [(2- methylpiperidin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCn1c(CN2CCCCC2C)nc2c1c(=O)n(c(=O)n2C)C

STK593666
Synonyms: N- (2- bromophenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1ccccc1Br

STK593668
Synonyms: methyl[(2,12,12- trimethyl- 12,13- dihydro- 10H- pyrano[4',3':4,5]thieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidin- 7- yl)sulfanyl]acetate
Smiles: COC(=O)CSc1nnc2n1c1sc3c(c1c1n2nc(n1)C)CC(OC3)(C)C

STK593669
Synonyms: 8- [(2E)- 2- (4- chlorobenzylidene)hydrazinyl]- 7- (4- fluorobenzyl)- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Fc1ccc(cc1)Cn1c(N/N=C/c2ccc(cc2)Cl)nc2c1c(O)nc(=O)n2C

STK593671
Synonyms: N'- [(E)- {4,6- dioxo- 2- sulfanyl- 1- [3- (trifluoromethyl)phenyl]- 1,6- dihydropyrimidin- 5(4H)- ylidene}methyl]benzohydrazide
Smiles: O=C(c1ccccc1)NN/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1)C(F)(F)F)S

STK593672
Synonyms: 7- (2- ethoxyethyl)- 6- hydroxy- 3- methyl- 8- (pentylsulfanyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCCCSc1nc2c(n1CCOCC)c(O)nc(=O)n2C

STK593675
Synonyms: 3- (2,5- dimethylbenzyl)- 8- (3- methoxyphenyl)- 1- methyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: COc1cccc(c1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1cc(C)ccc1C

STK593676
Synonyms: 7- (morpholin- 4- yl)- 4- (propan- 2- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: CC(c1nc2oc3c(c2c2c1CCC2)ncnc3N1CCOCC1)C

STK593677
Synonyms: methylN- [(2- ethylphenyl)carbamoyl]- D- valinate
Smiles: COC(=O)[C@@H](C(C)C)NC(=O)Nc1ccccc1CC

STK593678
Synonyms: 4- (9- benzyl- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)phenol
Smiles: Oc1ccc(cc1)c1nn2c(n1)c1c(nc2)sc2c1CCN(C2)Cc1ccccc1

STK593679
Synonyms: 1- (3- chlorophenyl)- 2- (6- methoxy- 1,3- benzothiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccc(c1)Cl)c(=O)c1c(o2)cccc1

STK593686
Synonyms: 4- chloro- N- [5- (4- chlorophenyl)- 7- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]benzenesulfonamide
Smiles: Clc1ccc(cc1)C1=CC(n2c(=N1)[nH]c(n2)NS(=O)(=O)c1ccc(cc1)Cl)c1ccccc1

STK593687
Synonyms: (3a'S,6a'R)- 7- chloro- 3'- methyl- 5'- (2- phenylethyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cccc1Cl

STK593688
Synonyms: N- (3- chlorophenyl)- 3- (2- methyl- 1H- benzimidazol- 1- yl)propanamide
Smiles: O=C(Nc1cccc(c1)Cl)CCn1c(C)nc2c1cccc2

STK593691
Synonyms: 2- [(3a'S,6a'R)- 5- fluoro- 5'- (4- methoxybenzyl)- 2,4',6'- trioxo- 1,2,3',3a',4',5',6',6a'- octahydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 3'- yl]acetamide
Smiles: COc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1cc(F)cc2

STK593693
Synonyms: 2- [(4,7- dimethylquinazolin- 2- yl)amino]- 6- {[(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]methyl}pyrimidin- 4- ol
Smiles: Oc1cc(CSc2nnc(s2)C)nc(n1)Nc1nc(C)c2c(n1)cc(cc2)C

STK593694
Synonyms: 7,7- dimethyl- 2- (3- methylphenyl)- 4- (prop- 2- en- 1- ylsulfanyl)- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidine
Smiles: C=CCSc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)C

STK593695
Synonyms: (4E)- 2- (2,4- dimethylphenyl)- 4- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)/C(=C/NCCCN2CCOCC2)/c2c(C1=O)cccc2

STK593696
Synonyms: 1- (2- methylprop- 2- en- 1- yl)- 6- propyl- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: CCCN1CNc2c(C1)c(=O)nc(n2CC(=C)C)S

STK593698
Synonyms: N- (2- chlorophenyl)- 1- (4- chlorophenyl)- 4- (4- fluorophenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: Fc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1ccccc1Cl)c1ccc(cc1)Cl

STK593699
Synonyms: 4- ({[3- (4- ethoxyphenyl)- 4- oxo- 3,4,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl]sulfanyl}methyl)benzonitrile
Smiles: CCOc1ccc(cc1)n1c(SCc2ccc(cc2)C#N)nc2c(c1=O)c1CCCCc1s2

STK593700
Synonyms: 7- methoxy- 2- methyl- 3- (1- phenyl- 1H- pyrazol- 4- yl)- 4H- chromene- 4- thione
Smiles: COc1ccc2c(c1)oc(c(c2=S)c1cnn(c1)c1ccccc1)C

STK593701
Synonyms: N- (3,4- difluorophenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1ccc(c(c1)F)F

STK593702
Synonyms: N- [(2E)- 5,5- dioxido- 3- phenyltetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 4- phenylbutanamide
Smiles: O=C(/N=C\1/SC2C(N1c1ccccc1)CS(=O)(=O)C2)CCCc1ccccc1

STK593704
Synonyms: 5- (2- chlorophenyl)- 4- {[(1E,2E)- 2- methyl- 3- phenylprop- 2- en- 1- ylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: C/C(=C\c1ccccc1)/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

STK593705
Synonyms: 5- (3- methylphenyl)- 4- {[(E)- (2,3,4- trimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1c(ccc(c1OC)OC)/C=N/n1c(=S)[nH]nc1c1cccc(c1)C

STK593706
Synonyms: 1,4- dimethyl- 2- oxo- 5- {(Z)- [4- oxo- 3- (3- phenylpropyl)- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 6- (thiomorpholin- 4- yl)- 1,2- dihydropyridine- 3- carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)CCCc2ccccc2)c(n(c1=O)C)N1CCSCC1

STK593707
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK593710
Synonyms: N- (4- chlorophenyl)- 2- ({6- cyano- 8,8- dimethyl- 5- [(4- methylphenyl)amino]- 7,10- dihydro- 8H- pyrano[3,4- c][1,2,4]triazolo[4,3- a]pyridin- 3- yl}sulfanyl)acetamide
Smiles: N#Cc1c(Nc2ccc(cc2)C)n2c(SCC(=O)Nc3ccc(cc3)Cl)nnc2c2c1CC(C)(C)OC2

STK593711
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- chlorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK593712
Synonyms: N- (3- chloro- 4- fluorophenyl)- 2- {[5- (2- fluorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)CSc1nnc(n1Cc1ccco1)c1ccccc1F

STK593714
Synonyms: 8- (hexylsulfanyl)- 6- hydroxy- 7- (2- methoxyethyl)- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCCCCSc1nc2c(n1CCOC)c(O)nc(=O)n2C

STK593715
Synonyms: 4- (benzylsulfanyl)- 7,7- dimethyl- 2- (4- methylphenyl)- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidine
Smiles: Cc1ccc(cc1)c1nc(SCc2ccccc2)c2c(n1)CC(OC2)(C)C

STK593716
Synonyms: (3a'S,6a'R)- 5'- (butan- 2- yl)- 5- chloro- 3'- [2- (methylsulfanyl)ethyl]- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CSCCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C(CC)C)C(=O)Nc1c2cc(Cl)cc1

STK593719
Synonyms: 2- (5- cyano- 1,2- dimethyl- 1H- pyrrol- 3- yl)- 4- imino- 9,10- dimethoxy- 6,7- dihydro- 4H- pyrido[2,1- a]isoquinoline- 3- carbonitrile
Smiles: COc1cc2CCn3c(c2cc1OC)cc(c(c3=N)C#N)c1cc(n(c1C)C)C#N

STK593722
Synonyms: (2Z)- 2- (3- bromobenzylidene)- 7- (morpholin- 4- ium- 4- ylmethyl)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: Brc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCOCC1)[O-]

STK593723
Synonyms: 2- [(2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 4- ylmethyl)acetamide
Smiles: O=C(NCc1ccncc1)COc1ccc2c(c1)oc(=O)cc2

STK593725
Synonyms: 5- (2- fluorophenyl)- 4- {[(E)- thiophen- 2- ylmethylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccccc1c1n[nH]c(=S)n1/N=C/c1cccs1

STK593726
Synonyms: (5E)- 6- hydroxy- 5- ({[2- (piperazin- 1- yl)ethyl]amino}methylidene)- 3- (prop- 2- en- 1- yl)pyrimidine- 2,4(3H,5H)- dione
Smiles: C=CCN1C(=O)N=C(/C(=C\NCCN2CCNCC2)/C1=O)O

STK593727
Synonyms: 2- ({4- (4- chlorophenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- ethoxyphenyl)acetamide
Smiles: CCOc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccc(cc1)C

STK593728
Synonyms: N- (4- ethoxyphenyl)- 2- {[4- (4- methylphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK593730
Synonyms: (5Z)- 5- (1,3- benzodioxol- 5- ylmethylidene)- 2- (3- bromophenyl)- 3- (1,3- thiazol- 2- yl)- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: Brc1cccc(c1)C1=N/C(=C\c2ccc3c(c2)OCO3)/C(=O)N1c1nccs1

STK593731
Synonyms: 5- ethoxy- N'- [(E)- (2- hydroxyphenyl)methylidene]- 1H- indole- 2- carbohydrazide
Smiles: CCOc1ccc2c(c1)cc([nH]2)C(=O)N/N=C/c1ccccc1O

STK593733
Synonyms: 1- (4- fluorophenyl)- 1'- methyl- 6'- nitro- 2'- propyl- 1',4'- dihydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinoline]- 2,4,6(1H,3H)- trione
Smiles: CCCC1N(C)c2ccc(cc2CC21C(=O)NC(=O)N(C2=O)c1ccc(cc1)F)[N+](=O)[O-]

STK593735
Synonyms: N- [(2S)- 3- methyl- 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)butanoyl]- L- methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)[C@@H](n1nnc2c(c1=O)cccc2)C(C)C

STK593736
Synonyms: N,N- diethyl- N'- (8- propyl- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- yl)ethane- 1,2- diamine
Smiles: CCCN1CCc2c(C1)sc1c2c(NCCN(CC)CC)nc2n1nnn2

STK593737
Synonyms: (Z)- N- {[11- (2- chlorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}- 1- phenylmethanimine
Smiles: Clc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)CO/N=C\c1ccccc1)c1ccccc1

STK593741
Synonyms: (4- chloro- 3- nitrophenyl)(6,7- dimethoxy- 1- methylidene- 3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: COc1cc2CCN(C(=C)c2cc1OC)C(=O)c1ccc(c(c1)[N+](=O)[O-])Cl

STK593742
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 5- (quinolin- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1c1ccc2c(c1)OCCO2)c1ccc2c(n1)cccc2

STK593743
Synonyms: 6- oxo- 6H- benzo[c]chromen- 3- yl2- {[(benzyloxy)carbonyl]amino}butanoate
Smiles: CCC(C(=O)Oc1ccc2c(c1)oc(=O)c1c2cccc1)NC(=O)OCc1ccccc1

STK593744
Synonyms: 2- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)- N- (2,3,4- trifluorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1F)F)F)CN1CCc2c(C1)cc1c(c2)OCCCO1

STK593745
Synonyms: 2- ({4- amino- 5- [5- (4- chlorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3,4- dichlorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK593746
Synonyms: (3S,3'S,3a'R,6a'S)- 7- chloro- 3'- (2- methylpropyl)- 5'- (prop- 2- en- 1- yl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: C=CCN1C(=O)[C@@H]2[C@H](C1=O)[C@@]1(N[C@H]2CC(C)C)C(=O)Nc2c1cccc2Cl

STK593747
Synonyms: 2- ({5- [(4- methylphenoxy)methyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (naphthalen- 1- yl)acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cccc3c2cccc3)nnc1COc1ccc(cc1)C

STK593748
Synonyms: 8- {[4- (4- methoxyphenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 7- (4- methylbenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1Cc1ccc(cc1)C)c(=O)n(c(=O)n2C)C

STK593749
Synonyms: 6- (2,6- dimethylmorpholin- 4- yl)- 5- [(Z)- {3- [2- (4- methoxyphenyl)ethyl]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene}methyl]- 1,4- dimethyl- 2- oxo- 1,2- dihydropyridine- 3- carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)CCc2ccc(cc2)OC)c(n(c1=O)C)N1CC(C)OC(C1)C

STK593751
Synonyms: (3a'S,6a'R)- 5'- [2- (3,4- dimethoxyphenyl)ethyl]- 5- fluoro- 3'- methyl- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(NC3C)C(=O)Nc3c2cc(F)cc3)ccc1OC

STK593753
Synonyms: N- [(2E)- 5- {[2- (dibenzo[b,d]furan- 3- ylamino)- 2- oxoethyl]sulfanyl}- 1,3,4- thiadiazol- 2(3H)- ylidene]- 3- phenylpropanamide
Smiles: O=C(Nc1ccc2c(c1)oc1c2cccc1)CSc1n[nH]/c(=N\C(=O)CCc2ccccc2)/s1

STK593756
Synonyms: 2',6'- dihydroxy- 2,4- dimethyl- 1,2,4,4a- tetrahydro- 4'H,6H- spiro[1,4- oxazino[4,3- a]quinoline- 5,5'- pyrimidin]- 4'- one
Smiles: CC1OC(C)C2N(C1)c1ccccc1CC12C(=NC(=NC1=O)O)O

STK593757
Synonyms: N- [(1Z)- 1- {1- cyano- 2- [(furan- 2- ylmethyl)amino]- 2- oxoethylidene}- 1H- isoindol- 3- yl]furan- 2- carboxamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccco1)/C(=O)NCc1ccco1

STK593758
Synonyms: 5- bromo- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- N,3- dimethyl- 1H- indole- 2- carboxamide
Smiles: Brc1ccc2c(c1)c(C)c([nH]2)C(=O)N(C1CCS(=O)(=O)C1)C

STK593759
Synonyms: N- (2- chloro- 4,6- dimethylphenyl)- 2- ({5- [(4- chlorophenoxy)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2c(C)cc(cc2Cl)C)nnc1COc1ccc(cc1)Cl

STK593761
Synonyms: N- [(2E)- 3- (3- methoxybenzyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 3- phenylpropanamide
Smiles: COc1cccc(c1)CN1/C(=N\C(=O)CCc2ccccc2)/SC2C1CS(=O)(=O)C2

STK593762
Synonyms: N- [(2Z)- 1,3- benzoxazol- 2(3H)- ylidene]- 5- (2- methylcyclohexyl)- 1,4,5,6- tetrahydro- 1,3,5- triazin- 2- amine
Smiles: CC1CCCCC1N1CNC(=NC1)/N=c/1\oc2c([nH]1)cccc2

STK593763
Synonyms: 2- (benzylsulfanyl)- 9- (2- methoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1ccccc1C1C2=C(O)CCCC2=Nc2n1nc(n2)SCc1ccccc1

STK593765
Synonyms: (4E)- 4- [(4- bromophenyl)(hydroxy)methylidene]- 5- (4- fluorophenyl)- 1- (2- hydroxyethyl)pyrrolidine- 2,3- dione
Smiles: OCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)Br)/O)/C1c1ccc(cc1)F

STK593767
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(2,4- dimethoxyphenyl)carbonyl]- 2'- [(3- methoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1ccc(c(c1)OC)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccc(c1)OC)C(=O)Nc1c2cccc1)cccc3

STK593770
Synonyms: 7- [(4- chlorobenzyl)sulfanyl]- 12- methyl- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidine
Smiles: CC1CCc2c(C1)c1c(s2)n2c(SCc3ccc(cc3)Cl)nnc2n2c1ncn2

STK593771
Synonyms: 2- [(4,8- dimethyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 3- ylmethyl)acetamide
Smiles: O=C(NCc1cccnc1)COc1ccc2c(c1C)oc(=O)cc2C

STK593772
Synonyms: 1',3',10- trimethyl- 2,3,4,4a- tetrahydro- 1H,2'H,6H,7H- spiro[pyrido[1',2':1,2]pyrimido[5,4- c]quinolizine- 5,5'- pyrimidine]- 2',4',6',7(1'H,3'H)- tetrone
Smiles: Cc1ccc2n(c1)c(=O)c1c(n2)N2CCCCC2C2(C1)C(=O)N(C)C(=O)N(C2=O)C

STK593773
Synonyms: 2- (8,8,10,10- tetramethyl- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)aniline
Smiles: Nc1ccccc1c1nc2n(n1)cnc1c2c2CC(C)(C)NC(c2s1)(C)C

STK593776
Synonyms: (1'S,3R,3'S,7a'S)- 5''- chloro- 1'- [(2,4- dichlorophenyl)carbonyl]- 7''- methyl- 5',6',7',7a'- tetrahydro- 1'H- dispiro[indole- 3,2'- pyrrolizine- 3',3''- indole]- 2,2''(1H,1''H)- dione
Smiles: Clc1ccc(c(c1)Cl)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(Cl)cc1C

STK593777
Synonyms: 3- [2- (methylsulfanyl)phenyl]tetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- imine5,5- dioxide
Smiles: CSc1ccccc1N1C(=N)SC2C1CS(=O)(=O)C2

STK593781
Synonyms: N- [(2Z)- 4- (4- chlorophenyl)- 1,3- thiazol- 2(3H)- ylidene]- 3- (2- oxo- 1,3- benzothiazol- 3(2H)- yl)propanamide
Smiles: Clc1ccc(cc1)c1cs/c(=N\C(=O)CCn2c(=O)sc3c2cccc3)/[nH]1

STK593782
Synonyms: N- [(2E)- 3- [4- (dimethylamino)phenyl]- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- (3- methylphenyl)acetamide
Smiles: O=C(/N=C\1/SC2C(N1c1ccc(cc1)N(C)C)CS(=O)(=O)C2)Cc1cccc(c1)C

STK593783
Synonyms: 4- methyl- N- (tetrazolo[1,5- a]quinoxalin- 4- yl)benzamide
Smiles: Cc1ccc(cc1)C(=O)Nc1nc2ccccc2n2c1nnn2

STK593787
Synonyms: ethyl4- [({(2E)- 4- hydroxy- 2- [(4- methoxyphenyl)imino]- 2,5- dihydro- 1,3- thiazol- 5- yl}acetyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CC1S/C(=N/c2ccc(cc2)OC)/N=C1O

STK593789
Synonyms: 8- (butan- 2- yl)- 4- hydroxy- 1,6,7- trimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: CCC(n1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C)C

STK593790
Synonyms: N- (3- chloro- 4- methylphenyl)- 2- {[3- (4- methoxyphenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)Cl)C)nc2c(c1=O)cccc2

STK593791
Synonyms: 2- {4- [(1- butyl- 1H- benzimidazol- 2- yl)methyl]piperazin- 1- yl}ethanol
Smiles: CCCCn1c(CN2CCN(CC2)CCO)nc2c1cccc2

STK593793
Synonyms: 1,3- dimethyl- 7- (naphthalen- 1- ylmethyl)- 8- [(4- phenylpiperazin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=c1n(C)c2nc(n(c2c(=O)n1C)Cc1cccc2c1cccc2)CN1CCN(CC1)c1ccccc1

STK593794
Synonyms: 1- (1',3'- dimethyl- 2',4',6'- trioxo- 1,1',2,3',4,4',4a,6'- octahydro- 2'H,6H- spiro[1,4- oxazino[4,3- a]quinoline- 5,5'- pyrimidin]- 8- yl)- 3- methylthiourea
Smiles: CNC(=S)Nc1ccc2c(c1)CC1(C3N2CCOC3)C(=O)N(C)C(=O)N(C1=O)C

STK593795
Synonyms: 2- (1,3- benzoxazol- 2- ylamino)- 4- (3- hydroxyphenyl)- 7,7- dimethyl- 4,6,7,8- tetrahydroquinazolin- 5- ol
Smiles: Oc1cccc(c1)C1N=C(Nc2nc3c(o2)cccc3)N=C2C1=C(O)CC(C2)(C)C

STK593797
Synonyms: (8S,8aR,11aS)- N- (1,3- benzodioxol- 5- yl)- 9,11- dioxo- 10- phenyl- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 8- carboxamide
Smiles: O=C([C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1)cccc3)Nc1ccc2c(c1)OCO2

STK593799
Synonyms: 8- ethoxy- N- (3- methoxypropyl)- 5H- pyrimido[5,4- b]indol- 4- amine
Smiles: COCCCNc1ncnc2c1[nH]c1c2cc(cc1)OCC

STK593800
Synonyms: 2- ({4- amino- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1cccc(c1)C(F)(F)F

STK593801
Synonyms: 7- chloro- 1',3'- diethyl- 3- methyl- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: CCN1C(=O)N(CC)C(=O)C2(C1=O)Cc1c(Cl)cccc1N1C2CN(C)CC1

STK593802
Synonyms: (3R)- N- [2- (cyclohex- 1- en- 1- yl)ethyl]- 2,2- dimethyl- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: O=C1c2ccccc2C2N1[C@H](C(=O)NCCC1=CCCCC1)C(S2)(C)C

STK593803
Synonyms: (2Z)- 7- [(4- methylpiperazin- 1- ium- 1- yl)methyl]- 3- oxo- 2- [(2E)- 3- phenylprop- 2- en- 1- ylidene]- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: CN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\C=C\c1ccccc1)/C2=O

STK593804
Synonyms: 1- ({3- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]phenyl}carbonyl)- L- proline
Smiles: O=C(N1CCC[C@H]1C(=O)O)c1cccc(c1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK593806
Synonyms: 3- {[4- (4- cyclohexylphenyl)- 1,3- thiazol- 2- yl]amino}- 6,7- dimethoxy- 2- benzofuran- 1(3H)- one
Smiles: COc1c(OC)ccc2c1C(=O)OC2Nc1scc(n1)c1ccc(cc1)C1CCCCC1

STK593808
Synonyms: 1- (4- chlorophenyl)- 2- (6- methyl- 1,3- benzothiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Clc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK593809
Synonyms: (4E)- 1- (furan- 2- ylmethyl)- 4- [hydroxy(3- nitrophenyl)methylidene]- 5- (2- methoxyphenyl)pyrrolidine- 2,3- dione
Smiles: COc1ccccc1C1/C(=C(/c2cccc(c2)[N+](=O)[O-])\O)/C(=O)C(=O)N1Cc1ccco1

STK593810
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK593811
Synonyms: methyl4- [({[5- (2- chlorophenyl)- 4- (4- ethoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)OC)nnc1c1ccccc1Cl

STK593812
Synonyms: N'- [2- (6- bromo- 2- methoxynaphthalen- 1- yl)acetyl]pyridine- 2- carbohydrazide
Smiles: COc1ccc2c(c1CC(=O)NNC(=O)c1ccccn1)ccc(c2)Br

STK593813
Synonyms: 9- methoxy- 6- (3- nitrobenzyl)- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 5(6H)- one
Smiles: COc1ccc2c(c1)c1nc3SCCn3c(=O)c1n2Cc1cccc(c1)[N+](=O)[O-]

STK593814
Synonyms: (2Z)- 2- (3- methylbenzylidene)- 7- (morpholin- 4- ium- 4- ylmethyl)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: Cc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCOCC1)[O-]

STK593815
Synonyms: 2- [(2- chlorobenzyl)sulfanyl]- 5- hydroxy- 4- (3,4,5- trimethoxyphenyl)- 4,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(SCc2ccccc2Cl)N=C2C(=C(O)CCC2)C1c1cc(OC)c(c(c1)OC)OC

STK593816
Synonyms: (4Z)- 2- (4- chlorophenyl)- 4- [2- (3,4- dimethoxyphenyl)- 4H- chromen- 4- ylidene]- 1,3- oxazol- 5(4H)- one
Smiles: COc1cc(ccc1OC)C1=C/C(=C\2/N=C(OC2=O)c2ccc(cc2)Cl)/c2c(O1)cccc2

STK593817
Synonyms: N- (2- fluorophenyl)- 2- {[5- (2- fluorophenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2F)nnc1c1ccccc1F

STK593818
Synonyms: propyl[(3,4- dimethoxyphenyl)(phenylamino)methyl][4- (dimethylamino)phenyl]phosphinate
Smiles: CCCOP(=O)(C(c1ccc(c(c1)OC)OC)Nc1ccccc1)c1ccc(cc1)N(C)C

STK593819
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 2- [(7- methyl- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 9- yl)oxy]acetamide
Smiles: O=C(NC1CCS(=O)(=O)C1)COc1cc(C)cc2c1c1CCCc1c(=O)o2

STK593820
Synonyms: N- {[trans- 4- ({[3- (2,3,5,9- tetramethyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)propanoyl]amino}methyl)cyclohexyl]carbonyl}- beta- alanine
Smiles: O=C(CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C)NC[C@@H]1CC[C@H](CC1)C(=O)NCCC(=O)O

STK593821
Synonyms: N- [(1Z)- 1- {1- cyano- 2- [(4- methylbenzyl)amino]- 2- oxoethylidene}- 1H- isoindol- 3- yl]- 4- methylbenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)C)/C(=O)NCc1ccc(cc1)C

STK593822
Synonyms: 7- (4- fluorobenzyl)- 6- hydroxy- 3- methyl- 8- (4- methylpiperazin- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)F)c(O)nc(=O)n2C

STK593823
Synonyms: N- (2,5- dimethoxybenzyl)- 5- fluoro- N- (prop- 2- en- 1- yl)- 1H- indole- 2- carboxamide
Smiles: C=CCN(C(=O)c1cc2c([nH]1)ccc(c2)F)Cc1cc(OC)ccc1OC

STK593824
Synonyms: 2'- hydroxy- 1',13- dimethyl- 1,2,3,4,5,5a- hexahydro- 4'H,7H,8H- spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[1,2- a]azepine- 6,5'- pyrimidine]- 4',6',8(1'H)- trione
Smiles: OC1=NC(=O)C2(C(=O)N1C)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2C

STK593825
Synonyms: 2- {[4- phenyl- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [2- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1nnc(n1c1ccccc1)c1cnccn1

STK593826
Synonyms: 8- [benzyl(methyl)amino]- 6- hydroxy- 3- methyl- 7- {3- [(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]propyl}- 3,7- dihydro- 2H- purin- 2- one
Smiles: O=c1nc(O)c2c(n1C)nc(n2CCCSc1nnnn1c1ccccc1)N(Cc1ccccc1)C

STK593829
Synonyms: N- (furan- 2- ylmethyl)- 2,2- dimethyl- 5- (2- methylpropyl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8- amine
Smiles: CC(Cc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCc1ccco1)C

STK593830
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- (4- ethylphenyl)- 1- (1,3- thiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: CCc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nccs1

STK593835
Synonyms: 10- methyl- 2,3- diphenylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: O=c1n(c2ccccc2)c(nc2c1c(=O)c1ccccc1n2C)c1ccccc1

STK593836
Synonyms: 2- [(3a'S,6a'R)- 7- chloro- 5'- (2- chlorobenzyl)- 2,4',6'- trioxo- 1,2,3',3a',4',5',6',6a'- octahydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 3'- yl]acetamide
Smiles: NC(=O)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cccc1Cl

STK593838
Synonyms: 2- {[3- cyano- 5- hydroxy- 4- (4- methoxyphenyl)- 7,7- dimethyl- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: COc1ccc(cc1)C1C(=C(SCC(=O)N(c2ccccc2)c2ccccc2)N=C2C1=C(O)CC(C2)(C)C)C#N

STK593839
Synonyms: N- {[trans- 4- ({[(2,3,5- trimethyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)acetyl]amino}methyl)cyclohexyl]carbonyl}- beta- alanine
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C)NC[C@@H]1CC[C@H](CC1)C(=O)NCCC(=O)O

STK593840
Synonyms: 3- {[4- (morpholin- 4- ylcarbonyl)cyclohexyl]methyl}quinazolin- 4(3H)- one
Smiles: O=C(N1CCOCC1)C1CCC(CC1)Cn1cnc2c(c1=O)cccc2

STK593841
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)F)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK593842
Synonyms: N- (2,3- dihydroimidazo[2,1- b][1,3]benzothiazol- 6- yl)- 4,5,6- trimethoxy- 1H- indole- 2- carboxamide
Smiles: COc1cc2[nH]c(cc2c(c1OC)OC)C(=O)Nc1ccc2c(c1)n1CCN=c1s2

STK593843
Synonyms: (5E)- 3- (4- bromophenyl)- 6- hydroxy- 5- ({[3- (1H- imidazol- 1- yl)propyl]amino}methylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: Brc1ccc(cc1)N1C(=O)N=C(/C(=C\NCCCn2cncc2)/C1=O)O

STK593845
Synonyms: N- [(2Z)- 3- (4- bromo- 2- chlorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]acetamide
Smiles: Brc1ccc(c(c1)Cl)N1/C(=N/C(=O)C)/SC2C1CS(=O)(=O)C2

STK593846
Synonyms: ethyl4- {(3E)- 2- (4- bromophenyl)- 3- [(4- chlorophenyl)(hydroxy)methylidene]- 4,5- dioxopyrrolidin- 1- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(c2ccc(cc2)Br)/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=O

STK593848
Synonyms: N- (4- chlorophenyl)- 6,7- dimethoxy- 3,4- dihydroisoquinoline- 2(1H)- carbothioamide
Smiles: COc1cc2CN(CCc2cc1OC)C(=S)Nc1ccc(cc1)Cl

STK593849
Synonyms: N- (3- chloro- 4- fluorophenyl)- 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]hexanamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK593850
Synonyms: (3S,3a'R,8a'S,8b'S)- 7- chloro- 2'- (2- methylphenyl)- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: O=C1N(c2ccccc2C)C(=O)[C@@H]2[C@H]1[C@@H]1CCCN1[C@]12C(=O)Nc2c1cccc2Cl

STK593851
Synonyms: N- [4- (diethylamino)phenyl]- 2- {[4- (furan- 2- ylmethyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C)CC

STK593852
Synonyms: tert- butyl(3S)- 3- ({2- [(3- methylphenyl)amino]- 2- oxoethyl}carbamoyl)- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: O=C(Nc1cccc(c1)C)CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK593854
Synonyms: 7- [2- (1,3- benzoxazol- 2- ylsulfanyl)ethyl]- 8- (dimethylamino)- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CN(c1nc2c(n1CCSc1nc3c(o1)cccc3)c(O)nc(=O)n2C)C

STK593855
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [2- chloro- 5- (trifluoromethyl)phenyl]acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cc(ccc2Cl)C(F)(F)F)nnc1COc1ccc(cc1)Cl

STK593856
Synonyms: 3- (2- methylpropyl)- 2- (4- nitrophenyl)- 4H- thiochromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: CC(Cn1c(nc2c(c1=O)c(=O)c1c(s2)cccc1)c1ccc(cc1)[N+](=O)[O-])C

STK593857
Synonyms: N- [(2Z)- 5- {[2- (naphthalen- 2- yl)- 2- oxoethyl]sulfanyl}- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: CC(=O)/N=c\1/[nH]nc(s1)SCC(=O)c1ccc2c(c1)cccc2

STK593858
Synonyms: ethyl1- [4- (diethylamino)phenyl]- 5- ethoxy- 2- methyl- 1H- benzo[g]indole- 3- carboxylate
Smiles: CCOC(=O)c1c2cc(OCC)c3c(c2n(c1C)c1ccc(cc1)N(CC)CC)cccc3

STK593860
Synonyms: 1- (4- ethoxyphenyl)- 4- (4- methoxyphenyl)- N- (4- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCOc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccc(cc1)C)cc3c1ccc(cc1)OC

STK593864
Synonyms: 2- methyl- N- [6- methyl- 2- (4- methylphenyl)- 5- oxo- 4- phenyl- 2,5- dihydropyridazin- 3- yl]benzamide
Smiles: Cc1ccc(cc1)n1nc(C)c(=O)c(c1NC(=O)c1ccccc1C)c1ccccc1

STK593867
Synonyms: 3- [2- (4- methylpiperazin- 1- yl)- 2- oxoethyl]- 1,2,3- benzotriazin- 4(3H)- one
Smiles: CN1CCN(CC1)C(=O)Cn1nnc2c(c1=O)cccc2

STK593871
Synonyms: 2- {[2- (4- methoxyphenyl)- 7,7- dimethyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)Nc2cccc(c2)C)c2c(n1)CC(OC2)(C)C

STK593872
Synonyms: 5- (4- chlorophenyl)- 1,3,7,7- tetramethyl- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: Clc1ccc(cc1)c1c2c(=O)n(C)c(=O)n(c2c2n1C(C)(C)COC2)C

STK593874
Synonyms: N- cyclopentyl- 4- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]benzamide
Smiles: O=C(c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)NC1CCCC1

STK593875
Synonyms: 6- chloro- 3,4- dimethyl- 9- (pyridin- 2- yl)- 9,10- dihydro- 2H,8H- chromeno[8,7- e][1,3]oxazin- 2- one
Smiles: Clc1cc2c(c3c1OCN(C3)c1ccccn1)oc(=O)c(c2C)C

STK593876
Synonyms: N- (2,5- dimethylphenyl)- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]furan- 2- carboxamide
Smiles: Cc1ccc(c(c1)N(C(=O)c1ccco1)Cc1cc2ccc(cc2[nH]c1=O)C)C

STK593879
Synonyms: 3- methyl- 6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 1- ylN- [(4- methylphenyl)sulfonyl]- L- valinate
Smiles: CC([C@@H](C(=O)Oc1cc(C)cc2c1c1CCCCc1c(=O)o2)NS(=O)(=O)c1ccc(cc1)C)C

STK593880
Synonyms: (4E)- 4- [(4- chlorophenyl)(hydroxy)methylidene]- 1- (4- methoxyphenyl)- 5- phenylpyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccccc1

STK593882
Synonyms: 3- cyclohexyl- N- [4- (propan- 2- yloxy)benzyl]- 3- [4- (propan- 2- yloxy)phenyl]propan- 1- amine
Smiles: CC(Oc1ccc(cc1)CNCCC(c1ccc(cc1)OC(C)C)C1CCCCC1)C

STK593883
Synonyms: N- benzyl- N- ethyl- 4,5,6- trimethoxy- 1H- indole- 2- carboxamide
Smiles: CCN(C(=O)c1cc2c([nH]1)cc(c(c2OC)OC)OC)Cc1ccccc1

STK593884
Synonyms: pentyl{[2- (4- methoxyphenyl)- 7,7- dimethyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}acetate
Smiles: CCCCCOC(=O)CSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)OC

STK593885
Synonyms: 4- [(E)- (7- iminio- 2- methyl- 5- oxo- 5H- [1,2]oxazolo[2,3- a]pyrimidin- 6(7H)- ylidene)methyl]phenolate
Smiles: [O-]c1ccc(cc1)/C=C\1/C(=O)N=c2n(C1=[NH2+])oc(c2)C

STK593886
Synonyms: N- (3,4- difluorophenyl)- 2- {[4- (4- ethoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)F)F)nnc1COc1ccccc1

STK593887
Synonyms: 6- chloro- 5- methyl- 2- [(3- nitrobenzyl)amino][1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: [O-][N+](=O)c1cccc(c1)CNc1nn2c(n1)nc(c(c2O)Cl)C

STK593888
Synonyms: N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (tetrahydrofuran- 2- ylmethyl)pyridine- 4- carboxamide
Smiles: O=C(c1ccncc1)N(Cc1cc2cccc(c2[nH]c1=O)C)CC1CCCO1

STK593889
Synonyms: 2- amino- 1- (2,4- dimethoxyphenyl)- N- (2- methoxyethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1OC)OC

STK593890
Synonyms: 2- {[6- cyano- 8,8- dimethyl- 5- (phenylamino)- 7,10- dihydro- 8H- pyrano[3,4- c][1,2,4]triazolo[4,3- a]pyridin- 3- yl]sulfanyl}- N- (2- nitrophenyl)acetamide
Smiles: N#Cc1c(Nc2ccccc2)n2c(SCC(=O)Nc3ccccc3[N+](=O)[O-])nnc2c2c1CC(C)(C)OC2

STK593891
Synonyms: 7- (4- fluorobenzyl)- 1,3- dimethyl- 8- [(4- phenylpiperazin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccc(cc1)Cn1c(CN2CCN(CC2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK593895
Synonyms: N- (3- chlorophenyl)- 2- {[5- (3- chlorophenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2)Cl)nnc1c1cccc(c1)Cl

STK593897
Synonyms: 3- (4- methylphenyl)- 7- phenyl- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: Cc1ccc(cc1)C1=NOC2(C1)CC(=O)N(C2=O)c1ccccc1

STK593898
Synonyms: (3S,3a'R,8a'S,8b'S)- 2'- (2,5- dichlorophenyl)- 7- ethyl- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: CCc1cccc2c1NC(=O)[C@]12N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(Cl)ccc1Cl

STK593899
Synonyms: N- (3- methoxypropyl)- 5,7- dimethyl[1,2,4]triazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: COCCCNC(=O)c1nn2c(n1)nc(cc2C)C

STK593900
Synonyms: (4E)- 4- [hydroxy(5- methylfuran- 2- yl)methylidene]- 5- (4- methoxyphenyl)- 1- [5- (methylsulfanyl)- 1,3,4- thiadiazol- 2- yl]pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(o2)C)\O)/C(=O)C(=O)N1c1nnc(s1)SC

STK593901
Synonyms: 1',6'- dimethyl- 1,3- bis(4- methylphenyl)- 1',4'- dihydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinoline]- 2,4,6(1H,3H)- trione
Smiles: Cc1ccc(cc1)N1C(=O)N(c2ccc(cc2)C)C(=O)C2(C1=O)CN(C)c1c(C2)cc(cc1)C

STK593903
Synonyms: (4Z)- N- (2- chlorophenyl)- 4- (hydroxyimino)- 3,6,6- trimethyl- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: O/N=C\1/CC(C)(C)Cc2c1c(C)c(o2)C(=O)Nc1ccccc1Cl

STK593904
Synonyms: (4E)- 1- (3- chloro- 4- methylphenyl)- 5- (2,5- dimethoxyphenyl)- 4- [hydroxy(phenyl)methylidene]pyrrolidine- 2,3- dione
Smiles: COc1ccc(c(c1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1ccc(c(c1)Cl)C)OC

STK593905
Synonyms: 3- (1,3- benzodioxol- 5- ylmethyl)- 1'- tert- butyl- 2'- hydroxy- 8- nitro- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 4',6'(1'H)- dione
Smiles: OC1=NC(=O)C2(C(=O)N1C(C)(C)C)Cc1cc(ccc1N1C2CN(CC1)Cc1ccc2c(c1)OCO2)[N+](=O)[O-]

STK593906
Synonyms: 3- (2- methoxyethyl)- 1- methyl- 8- (2- methylphenyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: COCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1C

STK593908
Synonyms: 8- (4- benzylpiperidin- 1- yl)- 7- (4- fluorobenzyl)- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Fc1ccc(cc1)Cn1c(nc2c1c(O)nc(=O)n2C)N1CCC(CC1)Cc1ccccc1

STK593912
Synonyms: N- (3,4- dichlorophenyl)- 1- (4- ethoxyphenyl)- 4- phenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCOc1ccc(cc1)c1c(C(=O)Nc2ccc(c(c2)Cl)Cl)n2c3c1CCCCn3c(c2)c1ccccc1

STK593914
Synonyms: 4- [(2E)- 2- (2- chloro- 6- fluorobenzylidene)hydrazinyl]- 5- (4- ethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1N/N=C/c1c(F)cccc1Cl

STK593915
Synonyms: 3- (4- methylphenyl)- 4- (4- nitrophenyl)- 5- phenyl- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: Cc1ccc(cc1)c1[nH]nc2c1C(c1ccc(cc1)[N+](=O)[O-])N(C2=O)c1ccccc1

STK593916
Synonyms: 3- (3- chlorobenzyl)- 4- methylpyrimido[1,2- a]benzimidazol- 2- ol
Smiles: Clc1cccc(c1)Cc1c(O)nc2n(c1C)c1ccccc1n2

STK593917
Synonyms: 1- (4- methoxyphenyl)- N- [(2S)- 3- methyl- 1- oxo- 1- (piperidin- 1- yl)butan- 2- yl]- 5- oxopyrrolidine- 3- carboxamide
Smiles: COc1ccc(cc1)N1CC(CC1=O)C(=O)N[C@H](C(=O)N1CCCCC1)C(C)C

STK593918
Synonyms: 4- {[(E)- biphenyl- 4- ylmethylidene]amino}- 5- (3- methoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)c1ccccc1

STK593924
Synonyms: ethyl4- [1- methyl- 3- (2- methylprop- 2- en- 1- yl)- 2,4- dioxo- 1,2,3,4,6,7- hexahydro- 8H- imidazo[2,1- f]purin- 8- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CC(=C)C

STK593925
Synonyms: 3- [(2,4- dichlorobenzyl)sulfanyl]- 4- (furan- 2- ylmethyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazole
Smiles: Cc1ccc(cc1)OCc1nnc(n1Cc1ccco1)SCc1ccc(cc1Cl)Cl

STK593926
Synonyms: 3- (3- chlorophenyl)- 2- [(3- ethoxypropyl)amino]- 7- methyl- 5,6,7,8- tetrahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: CCOCCCNc1nc2sc3c(c2c(=O)n1c1cccc(c1)Cl)CCN(C3)C

STK593927
Synonyms: N- (3- fluorophenyl)- 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)butanamide
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)Nc1cccc(c1)F

STK593928
Synonyms: N- (2- methoxyethyl)- 5,10- dimethyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: COCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CC(C)CC2

STK593929
Synonyms: 2- {[4- (2- fluorophenyl)piperazin- 1- yl]carbonyl}- 3,6,6- trimethyl- 6,7- dihydro- 1- benzofuran- 4(5H)- one
Smiles: O=C(c1oc2c(c1C)C(=O)CC(C2)(C)C)N1CCN(CC1)c1ccccc1F

STK593930
Synonyms: 4- [(3a'S,6a'R)- 7- chloro- 3'- (3,4- dihydroxybenzyl)- 5- methyl- 2,4',6'- trioxo- 1,2,2',3',3a',4',6',6a'- octahydro- 5'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 5'- yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(c(c2)O)O)C(=O)Nc2c1cc(C)cc2Cl

STK593931
Synonyms: 2- ({6- cyano- 8,8- dimethyl- 5- [(4- methylphenyl)amino]- 7,10- dihydro- 8H- pyrano[3,4- c][1,2,4]triazolo[4,3- a]pyridin- 3- yl}sulfanyl)- N- (naphthalen- 2- yl)acetamide
Smiles: N#Cc1c(Nc2ccc(cc2)C)n2c(SCC(=O)Nc3ccc4c(c3)cccc4)nnc2c2c1CC(C)(C)OC2

STK593933
Synonyms: 3- chloro- 4- [(4- iodophenyl)amino]- 1- (naphthalen- 1- yl)- 1H- pyrrole- 2,5- dione
Smiles: Ic1ccc(cc1)NC1=C(Cl)C(=O)N(C1=O)c1cccc2c1cccc2

STK593934
Synonyms: 5- (4- ethoxyphenyl)- 4- {[(E)- (3- methylphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1cccc(c1)C

STK593935
Synonyms: 2- phenyl- 6,7- dihydro- 5H- cyclopenta[d][1,2,4]triazolo[1,5- a]pyrimidin- 8- ol
Smiles: Oc1c2CCCc2nc2n1nc(n2)c1ccccc1

STK593937
Synonyms: 2- {benzyl[(10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)methyl]amino}ethanol
Smiles: OCCN(Cc1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2)Cc1ccccc1

STK593938
Synonyms: N- (2,6- dimethylphenyl)- 2- {[5- (3- methylphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1c(C)cccc1C)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C

STK593939
Synonyms: N- (2- tert- butylphenyl)- 2- {[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1C(C)(C)C)CSc1nnc(n1C)c1cccc(c1)Cl

STK593940
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [4- (dimethylamino)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)N(C)C)CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)C

STK593941
Synonyms: N- [(2Z)- 3- (2- methoxyphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- methylpropanamide
Smiles: COc1ccccc1N1/C(=N/C(=O)C(C)C)/SC2C1CS(=O)(=O)C2

STK593942
Synonyms: (2'S,3S,3'S,10b'R)- 3'- (phenylcarbonyl)- 2'- [(3,4,5- trimethoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1cc(cc(c1OC)OC)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK593944
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- ethylphenyl)acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)Cc1cccs1

STK593945
Synonyms: 5- (4- fluorophenyl)- 4- {[(E)- 1H- indol- 3- ylmethylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1c[nH]c2c1cccc2

STK593946
Synonyms: 3- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 5- [(4- nitrobenzyl)sulfanyl]- 4H- 1,2,4- triazol- 4- amine
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCc1ccc(cc1)[N+](=O)[O-]

STK593948
Synonyms: 2- (6- ethoxy- 1,3- benzothiazol- 2- yl)- 1- [3- (prop- 2- en- 1- yloxy)phenyl]- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: C=CCOc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)OCC)C(=O)c2c1c(=O)c1c(o2)cccc1

STK593950
Synonyms: N- [4- chloro- 3- (trifluoromethyl)phenyl]- 2- [(7- methyl- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 9- yl)oxy]acetamide
Smiles: O=C(Nc1ccc(c(c1)C(F)(F)F)Cl)COc1cc(C)cc2c1c1CCCc1c(=O)o2

STK593951
Synonyms: (5E)- 5- {1- [(3- fluorophenyl)amino]propylidene}- 6- hydroxy- 3- (2- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O)/Nc1cccc(c1)F

STK593952
Synonyms: N'- [(E)- furan- 2- ylmethylidene]- 5- [2- (naphthalen- 1- ylmethoxy)phenyl]- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccccc1OCc1cccc2c1cccc2)N/N=C/c1ccco1

STK593954
Synonyms: 5- (2- chloro- 5- nitrophenyl)- 4- hydroxy- 1,3- dimethyl- 3,5- dihydro- 1H- indeno[2',1':5,6]pyrido[2,3- d]pyrimidine- 2,6- dione
Smiles: Clc1ccc(cc1C1C2=C(N=c3c1c(O)n(C)c(=O)n3C)c1c(C2=O)cccc1)[N+](=O)[O-]

STK593955
Synonyms: N- (2,4- dichlorophenyl)- 6- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)hexanamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CCCCCn1nnc2c(c1=O)cccc2

STK593956
Synonyms: 2- (2- methoxyethyl)- 1- phenyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COCCN1C(=O)c2c(C1c1ccccc1)c(=O)c1c(o2)cccc1

STK593957
Synonyms: 10- (2,4- dimethoxyphenyl)- 1,3- dimethyl- 5- phenyl- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: COc1ccc(c(c1)OC)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1ccccc1)C

STK593959
Synonyms: N- (furan- 2- ylmethyl)- 11- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: O=C(c1nn2c(n1)c1c(nc2)sc2c1C(C)CCC2)NCc1ccco1

STK593960
Synonyms: (2Z)- N- (2- methylbenzyl)- 2- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 7(8H)- ylidene)ethanamide
Smiles: O=C(/C=C/1\NCCc2c1cc1OCCCOc1c2)NCc1ccccc1C

STK593961
Synonyms: N- [(2Z)- 1,3- benzothiazol- 2(3H)- ylidene]- 6- fluoro- 2- methylquinoline- 4- carboxamide
Smiles: Cc1nc2ccc(cc2c(c1)C(=O)/N=c/1\sc2c([nH]1)cccc2)F

STK593963
Synonyms: 9- (3- chlorophenyl)- 2- (ethylsulfanyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CCSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1cccc(c1)Cl

STK593964
Synonyms: 5- (3,4,5- trimethoxyphenyl)- 4- {[(E)- (2,4,5- trimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(OC)c(cc1/C=N/n1c(=S)[nH]nc1c1cc(OC)c(c(c1)OC)OC)OC

STK593966
Synonyms: morpholin- 4- yl{4- [3- (trifluoromethyl)- 4,5- dihydro- 1H- furo[2,3- g]indazol- 1- yl]phenyl}methanone
Smiles: O=C(c1ccc(cc1)n1nc(c2c1c1ccoc1CC2)C(F)(F)F)N1CCOCC1

STK593967
Synonyms: (E)- {2- [4- (dimethylamino)phenyl]- 1- [3- (morpholin- 4- ium- 4- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}(4- fluorophenyl)methanolate
Smiles: Fc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)N(C)C)N(C(=O)C1=O)CCC[NH+]1CCOCC1)/[O-]

STK593969
Synonyms: methylN- [(4- methylphenyl)carbamoyl]- L- methioninate
Smiles: CSCC[C@@H](C(=O)OC)NC(=O)Nc1ccc(cc1)C

STK593972
Synonyms: N- benzyl- 2- {[10,10- dimethyl- 5- (methylsulfanyl)- 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: CSc1nc2sc3c(c2c2n1c(SCC(=O)NCc1ccccc1)nn2)CC(OC3)(C)C

STK593975
Synonyms: 2- ({4- amino- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,4- difluorophenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1F)F

STK593976
Synonyms: N,4- bis(4- methylphenyl)- 1- phenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1c(c2ccccc2)c2c3n1cc(n3CCCC2)c1ccc(cc1)C

STK593977
Synonyms: N- (2,3- dichlorophenyl)- 3,3- dimethyl- 2- oxobicyclo[2.2.1]heptane- 1- carboxamide
Smiles: O=C(C12CCC(C1)C(C2=O)(C)C)Nc1cccc(c1Cl)Cl

STK593979
Synonyms: (2E)- N- [(2E)- 1,3- benzothiazol- 2(3H)- ylidene]- 3- (3,4- dimethoxyphenyl)prop- 2- enamide
Smiles: COc1cc(/C=C/C(=O)/N=c\2/sc3c([nH]2)cccc3)ccc1OC

STK593982
Synonyms: N- (7- methoxy- 2,3- dihydro- 1H- pyrrolo[2,3- b]quinolin- 1- yl)propanamide
Smiles: CCC(=O)NN1CCc2c1nc1cc(OC)ccc1c2

STK593983
Synonyms: 2- {5- [(2,6- dichlorobenzyl)sulfanyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}pyridine
Smiles: Cc1ccc(cc1)n1c(SCc2c(Cl)cccc2Cl)nnc1c1ccccn1

STK593984
Synonyms: 2- chloro- 4- {(Z)- [2- (3- iodophenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}- 6- methoxyphenylacetate
Smiles: COc1cc(/C=C/2\N=C(OC2=O)c2cccc(c2)I)cc(c1OC(=O)C)Cl

STK593986
Synonyms: N- (2- chlorophenyl)- 1- (4- methoxyphenyl)- 4- (4- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1Cl)cc3c1ccc(cc1)C

STK593987
Synonyms: 4- [4- (5- fluoro- 2- methoxybenzyl)piperazin- 1- yl]- 2,8,10- trimethylpyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidine
Smiles: COc1ccc(cc1CN1CCN(CC1)c1cc(C)nc2n1nc1c2c(C)cc(n1)C)F

STK593988
Synonyms: N- (4- bromophenyl)- 2- ({4- (furan- 2- ylmethyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK593990
Synonyms: N- [2- (cyclohex- 1- en- 1- yl)ethyl]- 3- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]propanamide
Smiles: O=C(CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)NCCC1=CCCCC1

STK593991
Synonyms: 8- [4- (2- chlorobenzyl)piperazin- 1- yl]- 7- ethyl- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccccc1Cl

STK593992
Synonyms: (E)- 1- benzofuran- 2- yl{1'- [3- (dimethylammonio)propyl]- 1- methyl- 2,4',5'- trioxo- 1,2- dihydro- 3'H- spiro[indole- 3,2'- pyrrolidin]- 3'- ylidene}methanolate
Smiles: C[NH+](CCCN1C(=O)C(=O)/C(=C(\c2cc3c(o2)cccc3)/[O-])/C21c1ccccc1N(C2=O)C)C

STK593993
Synonyms: 3- (4- methoxyphenyl)- 4- phenyl- 5- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 4H- 1,2,4- triazole
Smiles: COc1ccc(cc1)c1nnc(n1c1ccccc1)SC/C=C/c1ccccc1

STK593994
Synonyms: 7,7- dimethyl- 2- (3- methylphenyl)- 4- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidine
Smiles: CC(=C)CSc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)C

STK593996
Synonyms: 2- (6- fluoro- 1,3- benzothiazol- 2- yl)- 1- (4- hydroxy- 3- methoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cc(ccc1O)C1N(c2nc3c(s2)cc(cc3)F)C(=O)c2c1c(=O)c1c(o2)cccc1

STK593997
Synonyms: N- butyl- 4- methyl- N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzenesulfonamide
Smiles: CCCCN(S(=O)(=O)c1ccc(cc1)C)Cc1cc2cccc(c2[nH]c1=O)C

STK593998
Synonyms: 2- chloro- N- (2,3- dimethylphenyl)- N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: Cc1c(C)cccc1N(C(=O)c1ccccc1Cl)Cc1cc2cccc(c2[nH]c1=O)C

STK593999
Synonyms: 2- (3,4- dimethoxyphenyl)- N- [(2Z)- 5,5- dioxido- 3- phenyltetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]acetamide
Smiles: COc1ccc(cc1OC)CC(=O)/N=C/1\SC2C(N1c1ccccc1)CS(=O)(=O)C2

STK594000
Synonyms: methyl4- {(3E)- 1- {5- [(2- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}- 3- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 4,5- dioxopyrrolidin- 2- yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(c2nnc(s2)SCc2ccccc2Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK594001
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- chlorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [4- (diethylamino)phenyl]acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl)CC

STK594003
Synonyms: 5- {2- [(2- chlorobenzyl)oxy]phenyl}- N'- [(E)- (4- methoxyphenyl)methylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)c1n[nH]c(c1)c1ccccc1OCc1ccccc1Cl

STK594004
Synonyms: 8- (4- fluorophenyl)- 4- hydroxy- 1,7- dimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Fc1ccc(cc1)n1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK594008
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- chloro- 2- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1C)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK594009
Synonyms: (5E)- 5- {[1- (3,4- dichlorobenzyl)- 1H- indol- 3- yl]methylidene}- 3- (furan- 2- ylmethyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C\c2cn(c3c2cccc3)Cc2ccc(c(c2)Cl)Cl)/C(=O)N1Cc1ccco1

STK594010
Synonyms: N- (2- chlorophenyl)- 4- (4- chlorophenyl)- 1- (4- ethoxyphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCOc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1Cl)cc3c1ccc(cc1)Cl

STK594011
Synonyms: 5,10,10- trimethyl- N- [3- (morpholin- 4- yl)propyl]- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: O=C(c1nn2c(n1)c1c(nc2C)sc2c1CC(C)(C)OC2)NCCCN1CCOCC1

STK594014
Synonyms: 2- phenyl- 1,10b- dihydro- 2'H- spiro[pyrazolo[1,5- c][1,3]benzoxazine- 5,4'- [1,3]thiazinane]- 2'- thione
Smiles: S=C1SCCC2(N1)Oc1ccccc1C1N2N=C(C1)c1ccccc1

STK594015
Synonyms: 8- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 3,4,7,8,9,10- hexahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline
Smiles: O=S(=O)(c1ccc2c(c1)OCCO2)N1CCc2c(C1)cc1c(c2)OCCCO1

STK594016
Synonyms: 5- {[4- (diethylammonio)benzyl]amino}- 2- (morpholin- 4- yl)benzoate
Smiles: CC[NH+](c1ccc(cc1)CNc1ccc(c(c1)C(=O)[O-])N1CCOCC1)CC

STK594018
Synonyms: 5- {5- [(3- fluorobenzyl)sulfonyl]- 1,3,4- oxadiazol- 2- yl}pentan- 1- amine
Smiles: NCCCCCc1nnc(o1)S(=O)(=O)Cc1cccc(c1)F

STK594019
Synonyms: 7- chloro- 2- (6- methoxy- 1,3- benzothiazol- 2- yl)- 1- (4- methoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)OC)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK594020
Synonyms: (2'S,3R,3'S,7a'S)- 7''- ethyl- 2'- [(4- fluorophenyl)carbonyl]- 5',6',7',7a'- tetrahydrodispiro[indole- 3,1'- pyrrolizine- 3',3''- indole]- 2,2''(1H,1''H)- dione
Smiles: CCc1cccc2c1NC(=O)[C@]12N2CCC[C@H]2[C@]2([C@@H]1C(=O)c1ccc(cc1)F)C(=O)Nc1c2cccc1

STK594021
Synonyms: N- [(3- amino- 6- ethyl- 5- methylthieno[2,3- b]pyridin- 2- yl)carbonyl]glycine
Smiles: CCc1nc2sc(c(c2cc1C)N)C(=O)NCC(=O)O

STK594022
Synonyms: 4- ({[(3S)- 2- (tert- butoxycarbonyl)- 1,2,3,4- tetrahydroisoquinolin- 3- yl]carbonyl}amino)butanoicacid
Smiles: OC(=O)CCCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK594023
Synonyms: 1- (4- fluorophenyl)- 2- {[4- phenyl- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}ethanone
Smiles: Fc1ccc(cc1)C(=O)CSc1nnc(n1c1ccccc1)c1ccccn1

STK594025
Synonyms: (4- bromophenyl)(6,7- dimethoxy- 1- methylidene- 3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: COc1cc2c(cc1OC)CCN(C2=C)C(=O)c1ccc(cc1)Br

STK594026
Synonyms: 2- ({5- [(4- methylphenoxy)methyl]- 4- phenyl- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,4,6- trimethylphenyl)acetamide
Smiles: Cc1ccc(cc1)OCc1nnc(n1c1ccccc1)SCC(=O)Nc1c(C)cc(cc1C)C

STK594027
Synonyms: 9- methyl- 2- [3- (propan- 2- yloxy)phenyl]- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CN1CCc2c(C1)sc1c2c2nc(nn2cn1)c1cccc(c1)OC(C)C

STK594028
Synonyms: 1- fluoro- 1',3'- dimethyl- 6a,7,8,9,10,11- hexahydro- 2'H,5H- spiro[azepino[1,2- a]quinoline- 6,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1cccc(c1N1C2CCCCC1)F

STK594030
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(4- fluorophenyl)carbonyl]- 2'- [(4- propoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: CCCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)F)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK594031
Synonyms: (4E)- 4- [hydroxy(4- methoxyphenyl)methylidene]- 1- methyl- 5- (4- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])C)/O

STK594032
Synonyms: 4- {[(E)- (4- tert- butylphenyl)methylidene]amino}- 5- (3- ethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(C)(C)C

STK594033
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(2- methoxyphenyl)carbonyl]- 2'- [(3- propoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: CCCOc1cccc(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2OC)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK594036
Synonyms: 2- ({4- (4- chlorophenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3,4- dimethylphenyl)acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)C)C)nnc1COc1ccc(cc1)C

STK594037
Synonyms: 3- [(3,4- dichlorobenzyl)sulfanyl]- 4- (furan- 2- ylmethyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazole
Smiles: Cc1ccc(cc1)OCc1nnc(n1Cc1ccco1)SCc1ccc(c(c1)Cl)Cl

STK594038
Synonyms: N- [(1Z)- 1- {1- cyano- 2- [(3- methylbutyl)amino]- 2- oxoethylidene}- 1H- isoindol- 3- yl]- 3,4,5- trimethoxybenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1cc(OC)c(c(c1)OC)OC)/C(=O)NCCC(C)C

STK594039
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(2- chlorophenyl)carbonyl]- 2'- [(4- nitrophenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Clc1ccccc1C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)[N+](=O)[O-])C(=O)Nc1c2cccc1)cccc3

STK594041
Synonyms: N- [(2E)- 5,5- dioxido- 3- [4- (propan- 2- yl)phenyl]tetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 3- methylbutanamide
Smiles: CC(CC(=O)/N=C\1/SC2C(N1c1ccc(cc1)C(C)C)CS(=O)(=O)C2)C

STK594042
Synonyms: {[(4- fluorophenyl)amino][(2- oxo- 2- phenylethyl)sulfanyl]methylidene}propanedinitrile
Smiles: N#CC(=C(Nc1ccc(cc1)F)SCC(=O)c1ccccc1)C#N

STK594043
Synonyms: 2- chloro- N- [(1Z)- 1- {1- cyano- 2- [(2- methylpropyl)amino]- 2- oxoethylidene}- 1H- isoindol- 3- yl]benzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccccc1Cl)/C(=O)NCC(C)C

STK594044
Synonyms: (3E)- 3- (3,4- dimethoxybenzylidene)- 4- imino- 7,8- dimethyl- 3,4- dihydro- 2H- pyrimido[2,1- b][1,3]benzothiazol- 2- one
Smiles: COc1cc(ccc1OC)/C=C\1/C(=O)N=c2n(C1=N)c1cc(C)c(cc1s2)C

STK594045
Synonyms: 3- [(4- bromobenzyl)sulfanyl]- 5- [(4- chlorophenoxy)methyl]- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazole
Smiles: COc1ccc(cc1)n1c(COc2ccc(cc2)Cl)nnc1SCc1ccc(cc1)Br

STK594048
Synonyms: (1S)- 1- {5- [(2,5- dimethylbenzyl)sulfanyl]- 1,3,4- oxadiazol- 2- yl}- 3- (methylsulfanyl)propan- 1- amine
Smiles: CSCC[C@@H](c1nnc(o1)SCc1cc(C)ccc1C)N

STK594049
Synonyms: 6- methyl- 9- [3- (trifluoromethyl)phenyl]- 2,3,9,10- tetrahydro- 8H- cyclopenta[3,4]chromeno[6,7- e][1,3]oxazin- 4(1H)- one
Smiles: O=c1oc2c(C)c3OCN(Cc3cc2c2c1CCC2)c1cccc(c1)C(F)(F)F

STK594050
Synonyms: 1- (3- chlorophenyl)- 4- [4- (methylsulfanyl)phenyl]- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: CSc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)Cl

STK594051
Synonyms: N- [(3Z)- 1- (2- methylpropyl)- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]thiophene- 2- carboxamide
Smiles: CC(Cn1[nH]/c(=N\C(=O)c2cccs2)/c2c1nc1ccccc1c2)C

STK594052
Synonyms: (3R,3'S,5'S)- N- (2,5- dimethoxyphenyl)- 5- fluoro- 5'- (2- methylpropyl)- 2- oxo- 1,2- dihydrospiro[indole- 3,2'- pyrrolidine]- 3'- carboxamide
Smiles: COc1ccc(cc1NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(F)cc1)CC(C)C)OC

STK594053
Synonyms: 3- benzyl- 10- methyl- 2- propylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: CCCc1nc2c(c(=O)n1Cc1ccccc1)c(=O)c1c(n2C)cccc1

STK594054
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,5- dichlorophenyl)acetamide
Smiles: O=C(Nc1cc(Cl)cc(c1)Cl)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK594055
Synonyms: 2- [(3a'S,6a'R)- 5'- (3- cyano- 4,5,6,7- tetrahydro- 1- benzothiophen- 2- yl)- 6,7- dimethyl- 2,4',6'- trioxo- 1,2,3',3a',4',5',6',6a'- octahydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 3'- yl]acetamide
Smiles: N#Cc1c(sc2c1CCCC2)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1ccc(c2C)C

STK594056
Synonyms: (4E)- 1- (3- chloro- 4- methylphenyl)- 5- (4- chlorophenyl)- 4- [hydroxy(phenyl)methylidene]pyrrolidine- 2,3- dione
Smiles: Clc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1ccc(c(c1)Cl)C

STK594057
Synonyms: N- [(1- ethylpyrrolidin- 2- yl)methyl]- 3- methyl- 2- oxo- 2,3- dihydro- 1,3- benzoxazole- 6- sulfonamide
Smiles: CCN1CCCC1CNS(=O)(=O)c1ccc2c(c1)oc(=O)n2C

STK594058
Synonyms: 2- [3- (4- fluorophenyl)- 5- methyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl]- N- (2- methylpropyl)acetamide
Smiles: CC(CNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)F)C

STK594060
Synonyms: 7'- {(E)- [1- (4- fluorobenzyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}- 1,3- dimethyl- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- trion
Smiles: Fc1ccc(cc1)CN1C(=O)N=C(/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK594061
Synonyms: 7- (2- chloro- 6- fluorobenzyl)- 1,3- dimethyl- 8- [(4- methylpiperidin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC1CCN(CC1)Cc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C

STK594064
Synonyms: 4- [(2E)- 2- (quinolin- 4- ylmethylidene)hydrazinyl]- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine
Smiles: N(=C\c1ccnc2c1cccc2)/Nc1ncnc2c1c1CCCCc1s2

STK594065
Synonyms: N- benzyl- 4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 7- amine
Smiles: CC(Cc1nc2oc3c(c2c2c1CCC2)ncnc3NCc1ccccc1)C

STK594066
Synonyms: (1'S,3R,3'S,7a'S)- 6''- chloro- 7''- methyl- 1'- (thiophen- 2- ylcarbonyl)- 5',6',7',7a'- tetrahydro- 1'H- dispiro[indole- 3,2'- pyrrolizine- 3',3''- indole]- 2,2''(1H,1''H)- dione
Smiles: Clc1ccc2c(c1C)NC(=O)[C@@]12N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccs1

STK594067
Synonyms: 2- (morpholin- 4- ium- 4- yl)- 5- {[2- (trifluoromethyl)benzyl]amino}benzoate
Smiles: [O-]C(=O)c1cc(ccc1[NH+]1CCOCC1)NCc1ccccc1C(F)(F)F

STK594068
Synonyms: 1- amino- 4- [(2- hydroxyethyl)amino]- 2- (4- phenylpiperazin- 1- yl)anthracene- 9,10- dione
Smiles: OCCNc1cc(N2CCN(CC2)c2ccccc2)c(c2c1C(=O)c1ccccc1C2=O)N

STK594069
Synonyms: methylN- [(1,1- dioxido- 3- oxo- 1,2- benzothiazol- 2(3H)- yl)acetyl]- N- phenyl- beta- alaninate
Smiles: COC(=O)CCN(C(=O)CN1C(=O)c2c(S1(=O)=O)cccc2)c1ccccc1

STK594072
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(2- chlorophenyl)carbonyl]- 3'- (thiophen- 2- ylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1Cl)C(=O)Nc1c2cccc1)cccc3)c1cccs1

STK594074
Synonyms: (4E)- 1- benzyl- 4- [hydroxy(4- nitrophenyl)methylidene]- 5- (4- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])Cc1ccccc1)/c1ccc(cc1)[N+](=O)[O-]

STK594075
Synonyms: N- [2- (2- acetyl- 4,5- dimethoxyphenyl)ethyl]- 3- chloro- 5- methoxy- 4- propoxybenzamide
Smiles: CCCOc1c(Cl)cc(cc1OC)C(=O)NCCc1cc(OC)c(cc1C(=O)C)OC

STK594076
Synonyms: 2- hydroxy- 1- (4- methoxyphenyl)- 6- (propan- 2- yl)- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: COc1ccc(cc1)n1c(O)nc(=O)c2c1NCN(C2)C(C)C

STK594077
Synonyms: 2- {[5- (furan- 2- yl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1Cc1ccco1)c1ccco1

STK594079
Synonyms: 4- [(4- acetylphenyl)amino]- 1- methyl- 3- nitroquinolin- 2(1H)- one
Smiles: [O-][N+](=O)c1c(Nc2ccc(cc2)C(=O)C)c2ccccc2n(c1=O)C

STK594080
Synonyms: 3- [2- (cyclohex- 1- en- 1- yl)ethyl]- 5- [(2E)- 3- (4- ethoxyphenyl)prop- 2- enoyl]- 2,6- dihydroxypyrimidin- 4(3H)- one
Smiles: CCOc1ccc(cc1)/C=C/C(=O)c1c(O)nc(n(c1=O)CCC1=CCCCC1)O

STK594081
Synonyms: (4E)- 1- (4- ethoxyphenyl)- 4- [hydroxy(phenyl)methylidene]- 5- (3- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: CCOc1ccc(cc1)N1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2ccccc2)\O)/C(=O)C1=O

STK594082
Synonyms: (E)- 2,3- dihydro- 1,4- benzodioxin- 6- yl[2- (2- fluorophenyl)- 4,5- dioxo- 1- (pyridinium- 4- ylmethyl)pyrrolidin- 3- ylidene]methanolate
Smiles: [O-]/C(=C\1/C(=O)C(=O)N(C1c1ccccc1F)Cc1cc[nH+]cc1)/c1ccc2c(c1)OCCO2

STK594086
Synonyms: ethyl4- [(6- benzyl- 2,5- dimethyl- 3- phenylpyrazolo[1,5- a]pyrimidin- 7- yl)sulfanyl]- 3- oxobutanoate
Smiles: CCOC(=O)CC(=O)CSc1c(Cc2ccccc2)c(C)nc2n1nc(c2c1ccccc1)C

STK594087
Synonyms: N- [4- (acetylamino)phenyl]- 3- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CCn1nnc2c(c1=O)cccc2

STK594088
Synonyms: 6,7- dimethoxy- 1- methyl- 2- [(3- nitrophenyl)sulfonyl]- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1cc2CCN(C(c2cc1OC)C)S(=O)(=O)c1cccc(c1)[N+](=O)[O-]

STK594090
Synonyms: methyl4- ({2- [5- (acetylamino)- 3- methyl- 1H- pyrazol- 1- yl]- 1H- benzimidazol- 1- yl}methyl)benzoate
Smiles: COC(=O)c1ccc(cc1)Cn1c(nc2c1cccc2)n1nc(cc1NC(=O)C)C

STK594091
Synonyms: 2- [3- (4- fluorophenyl)- 5- methyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl]- N- (propan- 2- yl)acetamide
Smiles: CC(NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)F)C

STK594093
Synonyms: N- [4- (dimethylamino)phenyl]- 2- {[4- (4- ethoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)N(C)C)nnc1c1cccc(c1)C

STK594095
Synonyms: 5- (3- methoxyphenyl)- 4- {[(E)- phenylmethylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccccc1

STK594097
Synonyms: 5- (2- bromophenyl)- 4- {[(E)- (4- hydroxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Oc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccc1Br

STK594098
Synonyms: N- [(2S)- 1- (cyclopropylamino)- 3- methyl- 1- oxobutan- 2- yl]- 2,3- dihydro- 1H- imidazo[1,2- a]benzimidazole- 1- carboxamide
Smiles: CC([C@@H](C(=O)NC1CC1)NC(=O)N1CCn2c1nc1c2cccc1)C

STK594099
Synonyms: (5E)- 2- (3- bromophenyl)- 5- (4- methoxybenzylidene)- 3- (1,3- thiazol- 2- yl)- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: COc1ccc(cc1)/C=C\1/N=C(N(C1=O)c1nccs1)c1cccc(c1)Br

STK594100
Synonyms: N- (3- hydroxypropyl)- 2- [(7- methyl- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 9- yl)oxy]propanamide
Smiles: OCCCNC(=O)C(Oc1cc(C)cc2c1c1CCCc1c(=O)o2)C

STK594103
Synonyms: 3- (5- {(E)- [2- hydroxy- 1- (4- methylbenzyl)- 5- oxo- 1,5- dihydro- 4H- imidazol- 4- ylidene]methyl}furan- 2- yl)- 2- methylbenzoicacid
Smiles: Cc1ccc(cc1)CN1C(=N/C(=C/c2ccc(o2)c2cccc(c2C)C(=O)O)/C1=O)O

STK594106
Synonyms: 1- tert- butyl4- (4- butyl- 8- methyl- 2- oxo- 2H- chromen- 7- yl)piperidine- 1,4- dicarboxylate
Smiles: CCCCc1cc(=O)oc2c1ccc(c2C)OC(=O)C1CCN(CC1)C(=O)OC(C)(C)C

STK594112
Synonyms: [(3aR,4R,4aR,7aS,8R,8aR)- 3- (3,4- dimethoxyphenyl)- 5,7- dioxo- 3a,4,4a,5,7,7a,8,8a- octahydro- 6H- 4,8- methano[1,2]oxazolo[4,5- f]isoindol- 6- yl]aceticacid
Smiles: COc1cc(ccc1OC)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)CC(=O)O

STK594114
Synonyms: 2- chloro- N'- {(E)- [1- (4- fluorobenzyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}benzohydrazide
Smiles: Fc1ccc(cc1)CN1C(=O)N=C(/C(=C\NNC(=O)c2ccccc2Cl)/C1=O)O

STK594115
Synonyms: N- [(2Z)- 3- [2- (3,4- dimethoxyphenyl)ethyl]- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 3- methylbutanamide
Smiles: COc1cc(CCN2/C(=N/C(=O)CC(C)C)/SC3C2CS(=O)(=O)C3)ccc1OC

STK594116
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4- dimethoxyphenyl)acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)Cc1cccs1

STK594118
Synonyms: (5E)- 5- {[(1- benzylpiperidin- 4- yl)amino]methylidene}- 1- (butan- 2- yl)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CCC(N1C(=NC(=O)/C(=C\NC2CCN(CC2)Cc2ccccc2)/C1=O)S)C

STK594120
Synonyms: (4Z)- 6- [(4- benzylpiperazin- 1- yl)methyl]- 4- [(3- chloro- 4- methylphenyl)imino]- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: Nc1nc(CN2CCN(CC2)Cc2ccccc2)[nH]/c(=N/c2ccc(c(c2)Cl)C)/n1

STK594121
Synonyms: N- (2,6- dichlorophenyl)- 2- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)acetamide
Smiles: O=C(Nc1c(Cl)cccc1Cl)CN1CCc2c(C1)cc1c(c2)OCCCO1

STK594122
Synonyms: ethyl2- amino- 1- (2- {[(4- fluorophenyl)carbonyl]amino}ethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCNC(=O)c1ccc(cc1)F

STK594124
Synonyms: 8,8- dimethyl- 4- (prop- 2- en- 1- ylsulfanyl)- 7,10- dihydro- 8H- pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: C=CCSc1ncnc2c1oc1c2cc2c(n1)CC(OC2)(C)C

STK594125
Synonyms: (2S)- N- (3,5- dichlorophenyl)- 2- (4- oxoquinazolin- 3(4H)- yl)propanamide
Smiles: O=C([C@@H](n1cnc2c(c1=O)cccc2)C)Nc1cc(Cl)cc(c1)Cl

STK594126
Synonyms: 2- {[4- (2- methoxyphenyl)piperazin- 1- yl]carbonyl}- 3,6,6- trimethyl- 6,7- dihydro- 1- benzofuran- 4(5H)- one
Smiles: COc1ccccc1N1CCN(CC1)C(=O)c1oc2c(c1C)C(=O)CC(C2)(C)C

STK594128
Synonyms: 1'- benzyl- 9- methyl- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[benzo[g]pyrido[1,2- a][1,8]naphthyridine- 5,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: Cc1ccc2c(c1)cc1c(n2)N2CCCCC2C2(C1)C(=O)NC(=O)N(C2=O)Cc1ccccc1

STK594130
Synonyms: 8- [2- (3,4- dimethoxyphenyl)ethyl]- 1,7- dimethyl- 3- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COc1cc(ccc1OC)CCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK594131
Synonyms: N- [3- (3,4- dichlorophenyl)- 1- methyl- 4- oxo- 1,4- dihydroquinolin- 2- yl]- 3,4- dimethoxybenzamide
Smiles: COc1cc(ccc1OC)C(=O)Nc1c(c2ccc(c(c2)Cl)Cl)c(=O)c2c(n1C)cccc2

STK594134
Synonyms: 5- (3,4- dichlorophenyl)- N'- [(1E)- 1- (4- methylphenyl)ethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: Cc1ccc(cc1)/C(=N/NC(=O)c1n[nH]c(c1)c1ccc(c(c1)Cl)Cl)/C

STK594135
Synonyms: (1'S,3R,3'S,7a'S)- 5''- chloro- 1'- [(2- chlorophenyl)carbonyl]- 7''- methyl- 5',6',7',7a'- tetrahydro- 1'H- dispiro[indole- 3,2'- pyrrolizine- 3',3''- indole]- 2,2''(1H,1''H)- dione
Smiles: Clc1cc(C)c2c(c1)[C@]1(C(=O)N2)N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccccc1Cl

STK594139
Synonyms: 3,5- bis(2- methylpropyl)- 3H- pyrrolo[2',3':4,5]pyrimido[1,6- a]benzimidazol- 1- yl3- methylbutanoate
Smiles: CC(CC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CC(C)C)cccc3)CC(C)C)C

STK594140
Synonyms: 7- [(4- bromobenzyl)sulfanyl]- 11- methyl- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidine
Smiles: CC1CCc2c(C1)sc1c2c2ncnn2c2n1c(SCc1ccc(cc1)Br)nn2

STK594142
Synonyms: (4Z)- 2- (2- bromophenyl)- 4- [4- (propan- 2- yloxy)benzylidene]- 4H- imidazol- 5- ol
Smiles: CC(Oc1ccc(cc1)/C=C/1\N=C(N=C1O)c1ccccc1Br)C

STK594143
Synonyms: (5- bromo- 3- methyl- 1H- indol- 2- yl)(1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl)methanone
Smiles: Brc1ccc2c(c1)c(C)c([nH]2)C(=O)N1CCC2(CC1)OCCO2

STK594145
Synonyms: N- [2- (7- methoxy- 6- {(E)- [2- (2,4,6- trichlorophenyl)hydrazinylidene]methyl}- 1,3- benzodioxol- 5- yl)ethyl]- N- methylpropanamide
Smiles: CCC(=O)N(CCc1cc2OCOc2c(c1/C=N/Nc1c(Cl)cc(cc1Cl)Cl)OC)C

STK594146
Synonyms: 8- (azepan- 1- yl)- 7- [2- hydroxy- 3- (3- methylphenoxy)propyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1cccc(c1)OCC(Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCCC1)O

STK594149
Synonyms: 4- [(6E)- 5- iminio- 7- oxo- 6- (thiophen- 3- ylmethylidene)- 6,7- dihydro- 5H- [1,3,4]thiadiazolo[3,2- a]pyrimidin- 2- yl]phenolate
Smiles: [O-]c1ccc(cc1)c1nn2c(=NC(=O)/C(=C/c3cscc3)/C2=[NH2+])s1

STK594151
Synonyms: N- (4- chlorophenyl)- 2- {[4- (4- ethoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Cl)nnc1COc1ccccc1

STK594152
Synonyms: methylN- (prop- 2- en- 1- ylcarbamoyl)- L- leucinate
Smiles: C=CCNC(=O)N[C@H](C(=O)OC)CC(C)C

STK594153
Synonyms: 2- (ethylsulfanyl)- 9- (2- fluorophenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CCSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1ccccc1F

STK594154
Synonyms: 7- methyl- 3- {(Z)- [3- (2- methylpropyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (4- phenylpiperazin- 1- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CC(CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2)/C1=O)C

STK594155
Synonyms: 2- [(3,4- dimethoxyphenyl)sulfonyl]- 6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1cc(ccc1OC)S(=O)(=O)N1CCc2c(C1)cc(c(c2)OC)OC

STK594156
Synonyms: 1,7- dimethyl- 3- (3- phenylpropyl)- 8- (tetrahydrofuran- 2- ylmethyl)- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: Cn1c(=O)n(CCCc2ccccc2)c(=O)c2c1nc1n2cc(n1CC1CCCO1)C

STK594157
Synonyms: 7- (2- fluorobenzyl)- 1,3- dimethyl- 8- [(4- methylpiperazin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CN1CCN(CC1)Cc1nc2c(n1Cc1ccccc1F)c(=O)n(c(=O)n2C)C

STK594158
Synonyms: N- [(2E)- 6- ethoxy- 4- methylquinazolin- 2(1H)- ylidene]- 5- [3- (morpholin- 4- yl)propyl]- 1,4,5,6- tetrahydro- 1,3,5- triazin- 2- amine
Smiles: CCOc1ccc2c(c1)c(C)n/c(=N/C1=NCN(CN1)CCCN1CCOCC1)/[nH]2

STK594159
Synonyms: 2- ({4- amino- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (naphthalen- 1- yl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1cccc2c1cccc2

STK594160
Synonyms: N- (3- chlorophenyl)- 2- {[4- (4- methoxyphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Cl)nnc1Cc1cccs1

STK594161
Synonyms: methyl5- amino- 7- (1,3- benzodioxol- 5- yl)- 6- cyano- 2- methyl- 7H- thieno[3,2- b]pyran- 3- carboxylate
Smiles: COC(=O)c1c(C)sc2c1OC(=C(C2c1ccc2c(c1)OCO2)C#N)N

STK594162
Synonyms: 9- (5- methyl- 1,2- oxazol- 3- yl)- 8- (4- propoxyphenyl)- 8,9- dihydrobenzo[7,8]chromeno[2,3- c]pyrrole- 7,10- dione
Smiles: CCCOc1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c2ccccc2cc1

STK594163
Synonyms: 4- hydroxy- 1- methyl- 7,8- diphenyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Oc1nc(=O)n(c2c1n1cc(n(c1n2)c1ccccc1)c1ccccc1)C

STK594164
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(4- nitrophenyl)carbonyl]- 3'- {[4- (propan- 2- yloxy)phenyl]carbonyl}- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: CC(Oc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)[N+](=O)[O-])C(=O)Nc1c2cccc1)cccc3)C

STK594165
Synonyms: 3- [(4- chlorophenoxy)methyl]- 5- [(2,5- dimethylbenzyl)sulfanyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazole
Smiles: C=CCn1c(nnc1SCc1cc(C)ccc1C)COc1ccc(cc1)Cl

STK594166
Synonyms: 6,7- dimethoxy- 1- methyl- N- propyl- 3,4- dihydroisoquinoline- 2(1H)- carbothioamide
Smiles: CCCNC(=S)N1CCc2c(C1C)cc(c(c2)OC)OC

STK594168
Synonyms: 1- (4- fluorophenyl)- 2- ({5- [(4- methylphenoxy)methyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)ethanone
Smiles: Cc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)F)nnc1COc1ccc(cc1)C

STK594171
Synonyms: 2- ({4- amino- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3,4- dimethylphenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(c(c1)C)C

STK594173
Synonyms: N'- [(3Z)- 5- bromo- 2- oxo- 1,2- dihydro- 3H- indol- 3- ylidene]- 5- (2- chlorophenyl)- 1H- pyrazole- 3- carbohydrazide
Smiles: Brc1ccc2c(c1)/C(=N/NC(=O)c1n[nH]c(c1)c1ccccc1Cl)/C(=O)N2

STK594174
Synonyms: N'- [(E)- (2- chloro- 6- methylquinolin- 3- yl)methylidene]pyridine- 4- carbohydrazide
Smiles: Cc1ccc2c(c1)cc(c(n2)Cl)/C=N/NC(=O)c1ccncc1

STK594175
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK594176
Synonyms: N- [(1Z)- 1- {1- cyano- 2- [(3- methoxypropyl)amino]- 2- oxoethylidene}- 1H- isoindol- 3- yl]- 2- methylbenzamide
Smiles: COCCCNC(=O)/C(=C/1\N=C(c2c1cccc2)NC(=O)c1ccccc1C)/C#N

STK594177
Synonyms: 8- [4- (2- chlorobenzyl)piperazin- 1- yl]- 7- hexyl- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCCCCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccccc1Cl

STK594178
Synonyms: (4E)- 1- [5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]- 4- [hydroxy(4- methylphenyl)methylidene]- 5- (pyridin- 3- yl)pyrrolidine- 2,3- dione
Smiles: Cc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)c1nnc(s1)SCc1ccccc1)/O

STK594179
Synonyms: 9- (2- fluorophenyl)- 6- (2- methylphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Cc1ccccc1C1CC(=C2C(=Nc3n(C2c2ccccc2F)ncn3)C1)O

STK594180
Synonyms: 1- hydroxy- 5- methyl- 9- oxo- 9H- xanthen- 3- ylN- [(4- methylphenyl)sulfonyl]- D- leucinate
Smiles: CC(C[C@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C)NS(=O)(=O)c1ccc(cc1)C)C

STK594181
Synonyms: ethyl2- (butanoylamino)- 5- (propan- 2- yl)- 4,7- dihydro- 5H- thieno[2,3- c]pyran- 3- carboxylate
Smiles: CCCC(=O)Nc1sc2c(c1C(=O)OCC)CC(OC2)C(C)C

STK594182
Synonyms: (5E)- 1- (4- methoxyphenyl)- 5- [(2- phenyl- 1H- indol- 3- yl)methylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2c([nH]c3c2cccc3)c2ccccc2)/C1=O

STK594183
Synonyms: 1- benzyl- 2- [(4- ethylpiperazin- 1- yl)carbonyl]- 9- methylpyrido[1,2- a]pyrrolo[2,3- d]pyrimidin- 4(1H)- one
Smiles: CCN1CCN(CC1)C(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C

STK594184
Synonyms: (4E)- 5- (2- fluorophenyl)- 1- hexadecyl- 4- [hydroxy(4- methylphenyl)methylidene]pyrrolidine- 2,3- dione
Smiles: CCCCCCCCCCCCCCCCN1C(c2ccccc2F)/C(=C(/c2ccc(cc2)C)\O)/C(=O)C1=O

STK594187
Synonyms: 6- chloro- 3,4- dimethyl- 2- oxo- 2H- chromen- 7- ylN- [(benzyloxy)carbonyl]- L- isoleucinate
Smiles: CC[C@H]([C@@H](C(=O)Oc1cc2oc(=O)c(c(c2cc1Cl)C)C)NC(=O)OCc1ccccc1)C

STK594188
Synonyms: 4- {[(E)- (5- bromo- 2- fluorophenyl)methylidene]amino}- 5- (4- ethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1cc(Br)ccc1F

STK594189
Synonyms: N- benzyl- 2- (10- methoxy- 6- oxo- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 7(6H)- yl)acetamide
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2CC(=O)NCc1ccccc1

STK594190
Synonyms: 6- (3- chlorobenzyl)- 9- methoxy- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 5(6H)- one
Smiles: COc1ccc2c(c1)c1nc3SCCn3c(=O)c1n2Cc1cccc(c1)Cl

STK594191
Synonyms: 5- chloro- N,N- bis(2- methoxyethyl)- 1H- indole- 2- carboxamide
Smiles: COCCN(C(=O)c1cc2c([nH]1)ccc(c2)Cl)CCOC

STK594192
Synonyms: N- [(2Z)- 5- [(4- chlorobenzyl)sulfonyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]- 4- fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)/N=c\1/[nH]nc(s1)S(=O)(=O)Cc1ccc(cc1)Cl

STK594195
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(2,5- dimethoxyphenyl)carbonyl]- 3'- [(2- methoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1ccc(c(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2OC)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)OC

STK594197
Synonyms: (2E)- 1- cyclopentyl- 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 1(2H)- ylidene)ethanone
Smiles: COc1cc2/C(=C\C(=O)C3CCCC3)/NCCc2cc1OC

STK594201
Synonyms: 1'- (4- chlorophenyl)- 2'- hydroxy- 3- methyl- 8- nitro- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrido[1,2- a]quinoline- 5,5'- pyrimidine]- 4',6'(1'H)- dione
Smiles: CC1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N=C(N(C1=O)c1ccc(cc1)Cl)O

STK594204
Synonyms: N- methyl- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzenesulfonamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)c1ccccc1)C

STK594206
Synonyms: 10- (2- chlorophenyl)- 1,3- dimethyl- 5- phenyl- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: Clc1ccccc1C1OCCn2c1c1c(c2c2ccccc2)c(=O)n(c(=O)n1C)C

STK594207
Synonyms: 6- methyl- 5- (naphthalen- 1- ylmethyl)- 2- (4- phenylpiperazin- 1- yl)pyrimidin- 4- ol
Smiles: Cc1nc(nc(c1Cc1cccc2c1cccc2)O)N1CCN(CC1)c1ccccc1

STK594208
Synonyms: 1- methyl- 3- [(2S)- 1- oxo- 3- phenyl- 1- (piperidin- 1- yl)propan- 2- yl]quinazoline- 2,4(1H,3H)- dione
Smiles: O=c1n([C@H](C(=O)N2CCCCC2)Cc2ccccc2)c(=O)c2c(n1C)cccc2

STK594209
Synonyms: 2- {(E)- [2- (6- hydroxy- 3- methyl- 2- oxo- 7- propyl- 3,7- dihydro- 2H- purin- 9- ium- 8- yl)hydrazinylidene]methyl}- 6- methoxyphenolate
Smiles: CCCn1c(N/N=C/c2cccc(c2[O-])OC)[nH+]c2c1c(O)nc(=O)n2C

STK594211
Synonyms: 2- (4- tert- butylphenyl)- 3- (3- methoxypropyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COCCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1ccc(cc1)C(C)(C)C

STK594215
Synonyms: 5- (2- chlorophenyl)- 4- {[(E)- (2,3,4- trimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1c(ccc(c1OC)OC)/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

STK594217
Synonyms: 7- chloro- 1- (2,5- dimethoxyphenyl)- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(cc1C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl)OC

STK594218
Synonyms: 7- hydroxy- 3- (4- methoxyphenoxy)- 8- [(3- methylpiperidin- 1- yl)methyl]- 4H- chromen- 4- one
Smiles: COc1ccc(cc1)Oc1coc2c(c1=O)ccc(c2CN1CCCC(C1)C)O

STK594219
Synonyms: N- (2,3- dimethylphenyl)- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]furan- 2- carboxamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(c1cccc(c1C)C)C(=O)c1ccco1

STK594220
Synonyms: N- (3,4- difluorophenyl)- 4- (4- oxoquinazolin- 3(4H)- yl)butanamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CCCn1cnc2c(c1=O)cccc2

STK594222
Synonyms: methyl4- {[2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)butanoyl]amino}benzoate
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)Nc1ccc(cc1)C(=O)OC

STK594225
Synonyms: 2- ethoxy- 4- {(Z)- [2- (3- fluorophenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}phenylbutanoate
Smiles: CCCC(=O)Oc1ccc(cc1OCC)/C=C/1\N=C(OC1=O)c1cccc(c1)F

STK594227
Synonyms: N- (3,5- dichlorophenyl)- 2,8,10- trimethylpyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidin- 4- amine
Smiles: Clc1cc(cc(c1)Cl)Nc1cc(C)nc2n1nc1c2c(C)cc(n1)C

STK594228
Synonyms: (2S)- N- (4- fluorophenyl)- 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)propanamide
Smiles: O=C([C@@H](n1c(O)nc2c(c1=O)cccc2)C)Nc1ccc(cc1)F

STK594229
Synonyms: N- benzyl- 4- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]benzamide
Smiles: O=C(c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)NCc1ccccc1

STK594230
Synonyms: (5Z)- 5- (butan- 2- ylidene)- 2- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}- 1,3- thiazol- 4(5H)- one
Smiles: CC/C(=C/1\SC(=NC1=O)N1CCN(CC1)c1cccc(c1)C(F)(F)F)/C

STK594231
Synonyms: 8- benzyl- N- [2- (morpholin- 4- yl)ethyl]- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- amine
Smiles: O1CCN(CC1)CCNc1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1

STK594234
Synonyms: methyl2- [(3E)- 3- {hydroxy[4- (propan- 2- yloxy)phenyl]methylidene}- 4,5- dioxo- 2- phenylpyrrolidin- 1- yl]- 4- methyl- 1,3- thiazole- 5- carboxylate
Smiles: COC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)OC(C)C)/O)/C1c1ccccc1

STK594235
Synonyms: N- (3- bromophenyl)- 2- {[4- (4- methoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Br)nnc1c1cccc(c1)C

STK594236
Synonyms: methylN- [(2- methylpropyl)carbamoyl]- L- phenylalaninate
Smiles: COC(=O)[C@H](Cc1ccccc1)NC(=O)NCC(C)C

STK594237
Synonyms: 10- (3- chlorophenyl)- 9- hydroxy- 6,7,8,10- tetrahydro- 11H- indeno[1,2- b]quinolin- 11- one
Smiles: Clc1cccc(c1)C1C2=C(O)CCCC2=NC2=C1C(=O)c1c2cccc1

STK594239
Synonyms: 2- (1,3- benzothiazol- 2- yl)- 1- (4- ethoxy- 3- methoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1ccc(cc1OC)C1N(c2nc3c(s2)cccc3)C(=O)c2c1c(=O)c1c(o2)cccc1

STK594240
Synonyms: 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)- N- [2- (phenylsulfanyl)phenyl]acetamide
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)Nc1ccccc1Sc1ccccc1

STK594241
Synonyms: 8- {[4- (diphenylmethyl)piperazin- 1- yl]methyl}- 7- ethyl- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCn1c(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK594244
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(2,4- dichlorophenyl)carbonyl]- 2'- [(4- propylphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: CCCc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2Cl)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK594245
Synonyms: 2- (4- tert- butylphenyl)- 10- methyl- 3- (3- methylbutyl)pyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: CC(CCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccc(cc1)C(C)(C)C)C

STK594247
Synonyms: (2S)- N- butyl- 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- 3- phenylpropanamide
Smiles: CCCCNC(=O)[C@@H](n1c(O)nc2c(c1=O)cccc2)Cc1ccccc1

STK594249
Synonyms: (4E)- 5- (3- ethoxy- 4- hydroxyphenyl)- 4- [(4- ethoxyphenyl)(hydroxy)methylidene]- 1- [2- (2- hydroxyethoxy)ethyl]pyrrolidine- 2,3- dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OCC)/O)/C1c1ccc(c(c1)OCC)O

STK594250
Synonyms: 7- [(2,2- diethoxyethyl)sulfanyl]- 12,12- dimethyl- 12,13- dihydro- 10H- pyrano[4',3':4,5]thieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidine
Smiles: CCOC(CSc1nnc2n1c1sc3c(c1c1n2ncn1)CC(OC3)(C)C)OCC

STK594251
Synonyms: 3- [(4- bromobenzyl)sulfanyl]- 5- [5- (4- methylphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 4- amine
Smiles: Cc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCc1ccc(cc1)Br

STK594252
Synonyms: 3- (3- bromo- 4- fluorophenyl)- 2- phenyl- 5- (4- propoxyphenyl)dihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: CCCOc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(c(c1)Br)F

STK594253
Synonyms: 2- ({4- amino- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [4- (butan- 2- yl)phenyl]acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)OC)C

STK594254
Synonyms: 1- (4- ethylphenyl)- 4- (4- methoxyphenyl)- N- phenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCc1ccc(cc1)c1c(C(=O)Nc2ccccc2)n2c3c1CCCCn3c(c2)c1ccc(cc1)OC

STK594256
Synonyms: (3E)- 4- imino- 7,8- dimethyl- 3- [(4- oxo- 4H- chromen- 3- yl)methylidene]- 3,4- dihydro- 2H- pyrimido[2,1- b][1,3]benzothiazol- 2- one
Smiles: O=C1N=c2sc3c(n2C(=N)/C/1=C\c1coc2c(c1=O)cccc2)cc(c(c3)C)C

STK594257
Synonyms: (4E,5Z)- 5- [4- (dimethylamino)benzylidene]- 4- [(4- methoxyphenyl)imino]- 1,3- thiazolidin- 2- one
Smiles: COc1ccc(cc1)/N=C\1/NC(=O)S/C1=C\c1ccc(cc1)N(C)C

STK594258
Synonyms: 2- methoxy- 6- [4- (3- methylphenoxy)quinazolin- 2- yl]phenol
Smiles: COc1cccc(c1O)c1nc(Oc2cccc(c2)C)c2c(n1)cccc2

STK594259
Synonyms: 6- benzyl- 5- methyl- 2- {[4- (propan- 2- yl)benzyl]amino}[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Cc1nc2nc(nn2c(c1Cc1ccccc1)O)NCc1ccc(cc1)C(C)C

STK594260
Synonyms: (3a'S,6a'R)- 5'- (butan- 2- yl)- 5- chloro- 3'- (2- methylpropyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(C)C)C(=O)Nc2c1cc(Cl)cc2)C

STK594262
Synonyms: 3- {(Z)- [3- (3- ethoxypropyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (4- phenylpiperazin- 1- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCOCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2)/C1=O

STK594264
Synonyms: 1- methyl- 3- (3- methylbutyl)- 8- (2- methylphenyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CC(CCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1C)C

STK594265
Synonyms: 2- [(6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 3- yl)oxy]- N- (pyridin- 2- ylmethyl)propanamide
Smiles: O=C(C(Oc1ccc2c(c1)oc(=O)c1c2CCCC1)C)NCc1ccccn1

STK594267
Synonyms: 2- (6- chloro- 1,3- benzothiazol- 2- yl)- 1- [3- (prop- 2- en- 1- yloxy)phenyl]- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: C=CCOc1cccc(c1)C1N(c2sc3c(n2)ccc(c3)Cl)C(=O)c2c1c(=O)c1c(o2)cccc1

STK594268
Synonyms: 8- (3- methoxy- 4- propoxyphenyl)- 9- (5- methyl- 1,2- oxazol- 3- yl)- 8,9- dihydrobenzo[7,8]chromeno[2,3- c]pyrrole- 7,10- dione
Smiles: CCCOc1ccc(cc1OC)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c2ccccc2cc1

STK594269
Synonyms: 2- (10- methoxy- 6- oxo- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 7(6H)- yl)- N- [3- (methylsulfanyl)phenyl]acetamide
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2CC(=O)Nc1cccc(c1)SC

STK594270
Synonyms: tert- butyl(3S)- 3- ({(2S)- 3- methyl- 1- [(4- methylphenyl)amino]- 1- oxobutan- 2- yl}carbamoyl)- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: Cc1ccc(cc1)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK594271
Synonyms: (3R,3'S,3a'S,6a'R)- 5'- (2- fluorophenyl)- 3'- (4- hydroxybenzyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: Oc1ccc(cc1)C[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1ccccc1F)C(=O)Nc1c2cccc1

STK594272
Synonyms: tert- butyl(2- {5- [(2- fluorobenzyl)sulfonyl]- 1,3,4- oxadiazol- 2- yl}ethyl)carbamate
Smiles: O=C(OC(C)(C)C)NCCc1nnc(o1)S(=O)(=O)Cc1ccccc1F

STK594273
Synonyms: N- (3,4- dimethoxybenzyl)- 5- fluoro- N- (prop- 2- en- 1- yl)- 1H- indole- 2- carboxamide
Smiles: C=CCN(C(=O)c1cc2c([nH]1)ccc(c2)F)Cc1ccc(c(c1)OC)OC

STK594274
Synonyms: 4,7- dimethoxy- N'- {(E)- [4- (prop- 2- en- 1- yloxy)phenyl]methylidene}- 1H- indole- 2- carbohydrazide
Smiles: C=CCOc1ccc(cc1)/C=N/NC(=O)c1[nH]c2c(c1)c(OC)ccc2OC

STK594276
Synonyms: 2- chloro- 4- {(Z)- [2- (4- iodophenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}- 6- methoxyphenylacetate
Smiles: COc1cc(/C=C/2\N=C(OC2=O)c2ccc(cc2)I)cc(c1OC(=O)C)Cl

STK594277
Synonyms: (4E)- 4- [(4- chlorophenyl)(hydroxy)methylidene]- 5- (3- nitrophenyl)- 1- [3- (trifluoromethyl)phenyl]pyrrolidine- 2,3- dione
Smiles: Clc1ccc(cc1)/C(=C\1/C(c2cccc(c2)[N+](=O)[O-])N(C(=O)C1=O)c1cccc(c1)C(F)(F)F)/O

STK594278
Synonyms: (4E)- 2- (3- chlorophenyl)- 4- [(methylamino)methylidene]isoquinoline- 1,3(2H,4H)- dione
Smiles: CN/C=C\1/C(=O)N(c2cccc(c2)Cl)C(=O)c2c1cccc2

STK594279
Synonyms: N- [(2Z)- 3- (2- fluorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- phenylacetamide
Smiles: O=C(/N=C/1\SC2C(N1c1ccccc1F)CS(=O)(=O)C2)Cc1ccccc1

STK594281
Synonyms: methylN- [(2- fluorobenzyl)carbamoyl]- D- valinate
Smiles: COC(=O)[C@@H](C(C)C)NC(=O)NCc1ccccc1F

STK594282
Synonyms: 6- hydroxy- 3,7- dimethyl- 8- {(2E)- 2- [4- (propan- 2- yl)benzylidene]hydrazinyl}- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(c1ccc(cc1)/C=N/Nc1nc2c(n1C)c(O)nc(=O)n2C)C

STK594283
Synonyms: 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]- N- (4- methylbenzyl)hexanamide
Smiles: O=C(NCc1ccc(cc1)C)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK594285
Synonyms: 1- {5- chloro- 4- [(2- methoxybenzyl)amino]- 6- oxopyridazin- 1(6H)- yl}tricyclo[3.3.1.1~3,7~]decane- 2- carboxylicacid
Smiles: COc1ccccc1CNc1cnn(c(=O)c1Cl)C12CC3CC(C1)CC(C2C(=O)O)C3

STK594288
Synonyms: (4Z)- 2- (2,4- dichlorophenyl)- 4- (4- ethoxy- 3- methoxybenzylidene)- 1,3- oxazol- 5(4H)- one
Smiles: CCOc1ccc(cc1OC)/C=C/1\N=C(OC1=O)c1ccc(cc1Cl)Cl

STK594289
Synonyms: (4E)- 5- (4- ethoxyphenyl)- 4- [furan- 2- yl(hydroxy)methylidene]- 1- [2- (2- hydroxyethoxy)ethyl]pyrrolidine- 2,3- dione
Smiles: OCCOCCN1C(=O)C(=O)/C(=C(\c2ccco2)/O)/C1c1ccc(cc1)OCC

STK594290
Synonyms: 2- (furan- 2- yl)- 3- (furan- 2- ylmethyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: O=c1c2ccccc2oc2c1c(=O)n(c(n2)c1ccco1)Cc1ccco1

STK594291
Synonyms: 2- [4- (2,2- dimethyl- 5- propyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8- yl)piperazin- 1- yl]ethanol
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3N1CCN(CC1)CCO

STK594292
Synonyms: (3a'S,6a'R)- 5'- cyclohexyl- 3'- (3,4- dihydroxybenzyl)- 5- fluoro- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C1CCCCC1)Cc1ccc(c(c1)O)O)C(=O)N2

STK594293
Synonyms: 8- (4- ethoxyphenyl)- 1- methyl- 3- [2- (morpholin- 4- yl)ethyl]- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK594294
Synonyms: 7- [(4- methoxybenzyl)sulfanyl]- 11- methyl- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidine
Smiles: COc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CCC(C3)C

STK594296
Synonyms: 7- chloro- 6- (2- chloroethyl)- 2,5- dimethyl- 3- phenylpyrazolo[1,5- a]pyrimidine
Smiles: ClCCc1c(C)nc2n(c1Cl)nc(c2c1ccccc1)C

STK594297
Synonyms: 9- (2,4- difluorophenyl)- 6- methyl- 2,3,9,10- tetrahydro- 8H- cyclopenta[3,4]chromeno[6,7- e][1,3]oxazin- 4(1H)- one
Smiles: Fc1ccc(c(c1)F)N1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCC2

STK594299
Synonyms: 8- ethyl- N- (pyridin- 4- ylmethyl)- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- amine
Smiles: CCN1CCc2c(C1)sc1c2c(NCc2ccncc2)nc2n1nnn2

STK594300
Synonyms: (5E)- 3- benzyl- 5- (1- {[4- (dimethylamino)phenyl]amino}propylidene)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)O)/Nc1ccc(cc1)N(C)C

STK594301
Synonyms: 3- (3- methoxypropyl)- 2- (propan- 2- yl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COCCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)C(C)C

STK594302
Synonyms: (4E)- 2- (2,5- dimethoxyphenyl)- 4- {[(2- hydroxyethyl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: OCCN/C=C/1\c2ccccc2C(=O)N(C1=O)c1cc(OC)ccc1OC

STK594303
Synonyms: N- [(2Z)- 6- chloro- 4- phenylquinazolin- 2(1H)- ylidene]- 5- [3- (morpholin- 4- yl)propyl]- 1,4,5,6- tetrahydro- 1,3,5- triazin- 2- amine
Smiles: Clc1ccc2c(c1)c(n/c(=N\C1=NCN(CN1)CCCN1CCOCC1)/[nH]2)c1ccccc1

STK594304
Synonyms: 2- ({4- amino- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [4- (6- methyl- 1,3- benzothiazol- 2- yl)phenyl]acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1)c1nc2c(s1)cc(cc2)C

STK594305
Synonyms: (2'S,3S,3'S,10b'R)- 2'- (1- benzofuran- 2- ylcarbonyl)- 3'- (phenylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cc4c(o1)cccc4)C(=O)Nc1c2cccc1)cccc3)c1ccccc1

STK594306
Synonyms: methyl3- ({(1Z)- 1- [4- hydroxy- 1- (4- methylphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]ethyl}amino)benzoate
Smiles: COC(=O)c1cccc(c1)N/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)C)O)/C

STK594308
Synonyms: 3- [(2- ethyl[1]benzofuro[3,2- d]pyrimidin- 4- yl)ammonio]benzoate
Smiles: CCc1nc([NH2+]c2cccc(c2)C(=O)[O-])c2c(n1)c1ccccc1o2

STK594309
Synonyms: (2Z,5Z)- 2- [(2- chlorophenyl)imino]- 5- (3- hydroxy- 4- methoxybenzylidene)- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: COc1ccc(cc1O)/C=C/1\S/C(=N\c2ccccc2Cl)/N=C1O

STK594310
Synonyms: (5Z)- 2- (3- bromophenyl)- 5- (3,4- dimethoxybenzylidene)- 3- (1,3- thiazol- 2- yl)- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: COc1cc(ccc1OC)/C=C/1\N=C(N(C1=O)c1nccs1)c1cccc(c1)Br

STK594311
Synonyms: 3,4,8,9- tetramethyl- 1,6- diphenyl- 1,3a,4,6,9,10a- hexahydro- 4,9- methano[1,5]dioxocino[2,3- c:6,7- c']dipyrazole
Smiles: CC1=NN(C2C1C1(C)Oc3c(C(O2)(C1)C)c(nn3c1ccccc1)C)c1ccccc1

STK594312
Synonyms: 2- [(8- chloro- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- yl)oxy]- N- (pyridin- 4- ylmethyl)acetamide
Smiles: O=C(NCc1ccncc1)COc1cc2oc(=O)c3c(c2cc1Cl)CCC3

STK594313
Synonyms: 6- {(E)- [(2E)- (5- {2- [(4- bromophenyl)amino]- 2- oxoethyl}- 4- oxo- 1,3- thiazolidin- 2- ylidene)hydrazinylidene]methyl}- 2,3- dimethoxybenzoicacid
Smiles: COc1c(OC)ccc(c1C(=O)O)/C=N/N=C/1\NC(=O)C(S1)CC(=O)Nc1ccc(cc1)Br

STK594315
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- methoxyphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2OC)nnc1COc1ccc(cc1)Cl

STK594316
Synonyms: 1- (4- methoxyphenyl)- 6- (1- phenylethyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: COc1ccc(cc1)n1c(S)nc(=O)c2c1NCN(C2)C(c1ccccc1)C

STK594317
Synonyms: 2- {(3aR,4R,4aR,7aS,8R,8aR)- 3- [4- (benzyloxy)- 3- methoxyphenyl]- 5,7- dioxo- 3a,4,4a,5,7,7a,8,8a- octahydro- 6H- 4,8- methano[1,2]oxazolo[4,5- f]isoindol- 6- yl}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: COc1cc(ccc1OCc1ccccc1)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1sc2c(c1C#N)CCCC2

STK594318
Synonyms: [3- (difluoromethoxy)phenyl](6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: COc1cc2CCN(Cc2cc1OC)C(=O)c1cccc(c1)OC(F)F

STK594320
Synonyms: N- (3- fluoro- 4- methylphenyl)- 2- {[4- (prop- 2- en- 1- yl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)F)C)nnc1Cc1cccs1

STK594323
Synonyms: (1'S,3R,3'S,7a'S)- 6''- chloro- 7''- methyl- 1'- [(3- propoxyphenyl)carbonyl]- 5',6',7',7a'- tetrahydro- 1'H- dispiro[indole- 3,2'- pyrrolizine- 3',3''- indole]- 2,2''(1H,1''H)- dione
Smiles: CCCOc1cccc(c1)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2ccc(c1C)Cl

STK594324
Synonyms: N- (4- propyl- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl)ethane- 1,2- diamine
Smiles: CCCc1nc2sc3c(c2c2c1CCC2)ncnc3NCCN

STK594325
Synonyms: 4- methoxy- N- (7- methoxy- 2,3- dihydro- 1H- pyrrolo[2,3- b]quinolin- 1- yl)benzamide
Smiles: COc1ccc(cc1)C(=O)NN1CCc2c1nc1cc(OC)ccc1c2

STK594326
Synonyms: N- {4- [(3a'S,6a'R)- 5- chloro- 3'- (1H- indol- 3- ylmethyl)- 2,4',6'- trioxo- 1,2,2',3',3a',4',6',6a'- octahydro- 5'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 5'- yl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cc(Cl)cc2

STK594327
Synonyms: 9- (4- fluorophenyl)- 4- hydroxy- 1- methyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purin- 2(1H)- one
Smiles: Fc1ccc(cc1)N1CCCn2c1nc1c2c(O)nc(=O)n1C

STK594328
Synonyms: 4- {[(E)- (4- chlorophenyl)methylidene]amino}- 5- (4- ethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)Cl

STK594331
Synonyms: (4E)- 1- {5- [(4- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- [3- (prop- 2- en- 1- yloxy)phenyl]pyrrolidine- 2,3- dione
Smiles: C=CCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK594333
Synonyms: 2- (6- chloro- 1,3- benzothiazol- 2- yl)- 1- (3- fluorophenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Fc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)Cl)C(=O)c2c1c(=O)c1c(o2)cccc1

STK594334
Synonyms: 9- (2,2- diphenylethyl)- 6- methyl- 2,3,9,10- tetrahydro- 8H- cyclopenta[3,4]chromeno[6,7- e][1,3]oxazin- 4(1H)- one
Smiles: O=c1oc2c(C)c3OCN(Cc3cc2c2c1CCC2)CC(c1ccccc1)c1ccccc1

STK594335
Synonyms: 3- (2,4- dimethoxyphenyl)- 7- (4- methylphenyl)- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: COc1cc(OC)ccc1C1=NOC2(C1)CC(=O)N(C2=O)c1ccc(cc1)C

STK594336
Synonyms: (E)- [2- (2- fluorophenyl)- 4,5- dioxo- 1- (pyridinium- 4- ylmethyl)pyrrolidin- 3- ylidene](2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methanolate
Smiles: CC1Cc2c(O1)ccc(c2)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)Cc1cc[nH+]cc1)/[O-]

STK594337
Synonyms: 9- methoxy- 6- (4- methylbenzyl)- 6H- indolo[2,3- b]quinoxaline
Smiles: COc1ccc2c(c1)c1nc3ccccc3nc1n2Cc1ccc(cc1)C

STK594339
Synonyms: ethyl1'- tert- butyl- 2'- hydroxy- 8- nitro- 4',6'- dioxo- 1',2,3,4,4a,6'- hexahydro- 1H,4'H,6H- spiro[pyrido[1,2- a]quinoline- 5,5'- pyrimidine]- 3- carboxylate
Smiles: CCOC(=O)C1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N=C(N(C1=O)C(C)(C)C)O

STK594340
Synonyms: 9- (3- chlorophenyl)- 6- (2- hydroxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Clc1cccc(c1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1O

STK594343
Synonyms: 2- {[4- ethyl- 5- (2- fluorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- fluoro- 4- methylphenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(c(c2)F)C)nnc1c1ccccc1F

STK594344
Synonyms: 2- (2,4- dimethoxyphenyl)- 3- methyl- 5,6,7,8- tetrahydroquinoxaline1,4- dioxide
Smiles: COc1cc(OC)ccc1c1c(C)[n+]([O-])c2c([n+]1[O-])CCCC2

STK594345
Synonyms: 2- {[4- (4- methylphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [2- (propan- 2- yl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(C)C)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK594346
Synonyms: 6- chloro- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 7- methyl- N- (4- methylbenzyl)- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: Cc1ccc(cc1)CN(C(=O)c1cc(=O)c2c(o1)cc(c(c2)Cl)C)C1CCS(=O)(=O)C1

STK594347
Synonyms: 2- [4- (2- fluorophenyl)piperazin- 1- yl]- 7- methyl- 3- {(Z)- [3- (2- methylpropyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CC(CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2F)/C1=O)C

STK594351
Synonyms: N- [6- chloro- 4- oxo- 3- (3,4,5- trimethoxyphenyl)- 4H- chromen- 2- yl]- 4- fluorobenzamide
Smiles: COc1cc(cc(c1OC)OC)c1c(NC(=O)c2ccc(cc2)F)oc2c(c1=O)cc(cc2)Cl

STK594352
Synonyms: (4E)- 4- [(1,3- benzothiazol- 2- ylamino)methylidene]- 2- (3,4- dimethylphenyl)isoquinoline- 1,3(2H,4H)- dione
Smiles: O=C1N(c2ccc(c(c2)C)C)C(=O)c2c(/C/1=C\Nc1nc3c(s1)cccc3)cccc2

STK594354
Synonyms: ethyl4- {1- methyl- 3- [2- (morpholin- 4- yl)ethyl]- 2,4- dioxo- 1,2,3,4,6,7- hexahydro- 8H- imidazo[2,1- f]purin- 8- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK594355
Synonyms: 7- chloro- 6- methyl- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- (3,4,5- trimethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1c(OC)cc(cc1OC)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK594356
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,5- dimethylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cc(C)ccc2C)nnc1c1cccc(c1)Cl

STK594357
Synonyms: 2- [4- (2- fluorophenyl)piperazin- 1- yl]- 9- methyl- 3- [(Z)- (3- methyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccccc2F)/C1=O

STK594359
Synonyms: 2- (furan- 2- yl)- 3- hexyl- 8- methoxy- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: CCCCCCn1c(nc2c(c1=O)c(=O)c1c(o2)cc(cc1)OC)c1ccco1

STK594360
Synonyms: (5Z)- 6- hydroxy- 5- [2- (4- methoxyphenyl)- 2,3- dihydro- 1,5- benzothiazepin- 4(5H)- ylidene]- 3- (3- methoxypropyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COCCCN1C(=O)N=C(/C(=C/2\CC(Sc3c(N2)cccc3)c2ccc(cc2)OC)/C1=O)O

STK594361
Synonyms: 8- (2,4- dimethoxyphenyl)- 1,6,7- trimethyl- 3- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COc1cc(OC)ccc1n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CCN1CCCCC1

STK594363
Synonyms: 5- {3- [(4- chlorobenzyl)oxy]phenyl}- N'- [(E)- (2- hydroxynaphthalen- 1- yl)methylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: Clc1ccc(cc1)COc1cccc(c1)c1[nH]nc(c1)C(=O)N/N=C/c1c(O)ccc2c1cccc2

STK594364
Synonyms: 1- tert- butyl4- (6- chloro- 2- oxo- 4- propyl- 2H- chromen- 7- yl)piperidine- 1,4- dicarboxylate
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)C1CCN(CC1)C(=O)OC(C)(C)C

STK594366
Synonyms: 2- hydroxy- 3- methyl- 6- [(2E)- 1- methyl- 2- (pyridin- 2- ylmethylidene)hydrazinyl]pyrimidin- 4(3H)- one
Smiles: CN(c1cc(=O)n(c(n1)O)C)/N=C/c1ccccn1

STK594369
Synonyms: N- (2- methoxyethyl)- 5- propyl- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinolin- 8- amine
Smiles: CCCc1nc2oc3c(c2c2c1CCCC2)ncnc3NCCOC

STK594370
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 6- methyl- N- (pyridin- 2- ylmethyl)heptan- 1- amine
Smiles: CC(CCC(c1ccc2c(c1)OCO2)CCNCc1ccccn1)C

STK594372
Synonyms: methylN- ({4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}carbonyl)- D- phenylalaninate
Smiles: COC(=O)[C@H](NC(=O)N1CCN(CC1)c1cccc(c1)C(F)(F)F)Cc1ccccc1

STK594374
Synonyms: 4- phenyl- 7- {[2- (piperidin- 1- yl)ethyl]sulfanyl}- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidine
Smiles: C1CCN(CC1)CCSc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1

STK594375
Synonyms: 9- methyl- 2- (pyridin- 4- yl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CC1CCc2c(C1)sc1c2c2nc(nn2cn1)c1ccncc1

STK594376
Synonyms: N- (2- bromophenyl)- 2- ({5- [(4- methylphenoxy)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2Br)nnc1COc1ccc(cc1)C

STK594377
Synonyms: 4- hydroxy- 8- (3- methoxyphenyl)- 1,7- dimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: COc1cccc(c1)n1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK594379
Synonyms: (2S)- N- (3- acetylphenyl)- 3- methyl- 2- (4- oxoquinazolin- 3(4H)- yl)butanamide
Smiles: CC([C@H](n1cnc2c(c1=O)cccc2)C(=O)Nc1cccc(c1)C(=O)C)C

STK594381
Synonyms: 1- (3,4- dichlorophenyl)- 3- {N'- (4,6- dimethylpyrimidin- 2- yl)- N- [2- (1H- indol- 3- yl)ethyl]carbamimidoyl}urea
Smiles: O=C(N/C(=N/c1nc(C)cc(n1)C)/NCCc1c[nH]c2c1cccc2)Nc1ccc(c(c1)Cl)Cl

STK594382
Synonyms: 2- [4- (2- fluorophenyl)piperazin- 1- yl]- 3- {(Z)- [3- (3- methoxypropyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: COCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2F)/C1=O

STK594383
Synonyms: N- [(2Z)- 3- (3,4- dimethylphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]propanamide
Smiles: CCC(=O)/N=C/1\SC2C(N1c1ccc(c(c1)C)C)CS(=O)(=O)C2

STK594384
Synonyms: (4E)- 4- {[(5- chloropyridin- 2- yl)amino]methylidene}- 2- (2,4- dimethoxyphenyl)isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc(c(c1)OC)N1C(=O)/C(=C/Nc2ccc(cn2)Cl)/c2c(C1=O)cccc2

STK594385
Synonyms: (5s,7s)- 2- (5- bromo- 2- methoxyphenyl)- 5- butyl- 7- methyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: CCCC[C@]12CN3C[C@@](C2=O)(CN(C1)C3c1cc(Br)ccc1OC)C

STK594386
Synonyms: 2- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 5- nitrobenzaldehyde
Smiles: O=Cc1cc(ccc1N1CCN(CC1)Cc1ccc2c(c1)OCO2)[N+](=O)[O-]

STK594388
Synonyms: methyl4- [(3E)- 3- (hydroxy{4- [(3- methylbenzyl)oxy]phenyl}methylidene)- 1- (5- methyl- 1,3,4- thiadiazol- 2- yl)- 4,5- dioxopyrrolidin- 2- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(c2nnc(s2)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/O

STK594389
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (3- hydroxy- 4- methoxyphenyl)methylidene]- 5- {[methyl(phenyl)amino]methyl}- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: COc1ccc(cc1O)/C=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N

STK594390
Synonyms: (4E)- 4- {[(2- chloro- 4- fluorophenyl)amino]methylidene}- 2- (3,4- dimethylphenyl)isoquinoline- 1,3(2H,4H)- dione
Smiles: Fc1ccc(c(c1)Cl)N/C=C\1/C(=O)N(c2ccc(c(c2)C)C)C(=O)c2c1cccc2

STK594392
Synonyms: 7,7- dimethyl- 2- (3- methylphenyl)- 4- {[2- (pyrrolidin- 1- yl)ethyl]sulfanyl}- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidine
Smiles: Cc1cccc(c1)c1nc(SCCN2CCCC2)c2c(n1)CC(OC2)(C)C

STK594393
Synonyms: ethyl4- [(3a'S,6a'R)- 5- chloro- 3'- (3,4- dihydroxybenzyl)- 2,4',6'- trioxo- 1,2,2',3',3a',4',6',6a'- octahydro- 5'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 5'- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(c(c2)O)O)C(=O)Nc2c1cc(Cl)cc2

STK594396
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 2- [(4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]acetamide
Smiles: O=C(NC1CCS(=O)(=O)C1)COc1ccc2c(c1)oc(=O)cc2C

STK594397
Synonyms: 2- {[4- phenyl- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1c1ccccc1)c1nccnc1

STK594398
Synonyms: (3a'S,6a'R)- 7- chloro- 5'- [2- (3,4- dimethoxyphenyl)ethyl]- 3'- (1- hydroxyethyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(NC3C(O)C)C(=O)Nc3c2cccc3Cl)ccc1OC

STK594399
Synonyms: 5- {4- [(2- chlorobenzyl)oxy]phenyl}- N'- [(E)- phenylmethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccc(cc1)OCc1ccccc1Cl)N/N=C/c1ccccc1

STK594400
Synonyms: 12- (3,4- dimethoxyphenyl)- 2- (2- hydroxyphenyl)- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: COc1ccc(cc1OC)C1C2=C(CCCC2=O)Oc2c1c1nc(nn1cn2)c1ccccc1O

STK594401
Synonyms: 2- (3- ethoxy- 4- methoxyphenyl)- 4- imino- 9,10- dimethoxy- 6,7- dihydro- 4H- pyrido[2,1- a]isoquinoline- 3- carbonitrile
Smiles: CCOc1cc(ccc1OC)c1cc2c3cc(OC)c(cc3CCn2c(=N)c1C#N)OC

STK594402
Synonyms: (3Z)- 1- hexyl- 3- (4- hydroxy- 2- oxo- 1,3- thiazol- 5(2H)- ylidene)- 1,3- dihydro- 2H- indol- 2- one
Smiles: CCCCCCN1c2ccccc2/C(=C\2/SC(=O)N=C2O)/C1=O

STK594403
Synonyms: N- [N'- (4,6- dimethylpyrimidin- 2- yl)- N- (4- methoxyphenyl)carbamimidoyl]- 10H- phenothiazine- 10- carboxamide
Smiles: COc1ccc(cc1)N/C(=N\c1nc(C)cc(n1)C)/NC(=O)N1c2ccccc2Sc2c1cccc2

STK594405
Synonyms: (4- fluorophenyl)(8- methoxy- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)methanone
Smiles: COc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)c1ccc(cc1)F

STK594406
Synonyms: N- [4- (butan- 2- yl)phenyl]- 2- {[4- (4- chlorophenyl)- 5- (2- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccc1OC)C

STK594408
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(1E)- 2,3- dihydro- 1H- inden- 1- ylidene]- 5- (4- propoxyphenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/1\CCc2c1cccc2

STK594409
Synonyms: 8,8- dimethyl- 3- {[2- (3- nitrophenyl)- 2- oxoethyl]sulfanyl}- 5- (phenylamino)- 7,10- dihydro- 8H- pyrano[3,4- c][1,2,4]triazolo[4,3- a]pyridine- 6- carbonitrile
Smiles: N#Cc1c(Nc2ccccc2)n2c(SCC(=O)c3cccc(c3)[N+](=O)[O-])nnc2c2c1CC(C)(C)OC2

STK594411
Synonyms: N- (3- fluoro- 4- methylphenyl)- 2- {[4- (4- methylphenyl)- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)F)C)CSc1nnc(n1c1ccc(cc1)C)c1ccncc1

STK594414
Synonyms: 4- [2- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 6- phenylpyrimidin- 4- yl]morpholine
Smiles: Cc1cc(n(n1)c1nc(cc(n1)c1ccccc1)N1CCOCC1)C

STK594416
Synonyms: 4- chloro- N- (3- methylphenyl)- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzenesulfonamide
Smiles: Cc1cccc(c1)N(S(=O)(=O)c1ccc(cc1)Cl)Cc1cc2ccccc2[nH]c1=O

STK594417
Synonyms: methyl[8- (4- methoxyphenyl)- 1- methyl- 2,4- dioxo- 1,2,4,6,7,8- hexahydro- 3H- imidazo[2,1- f]purin- 3- yl]acetate
Smiles: COC(=O)Cn1c(=O)c2n3CCN(c3nc2n(c1=O)C)c1ccc(cc1)OC

STK594418
Synonyms: N- (furan- 2- ylmethyl)- 4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 7- amine
Smiles: CC(Cc1nc2oc3c(c2c2c1CCC2)ncnc3NCc1ccco1)C

STK594421
Synonyms: 2- {[5- (4- tert- butylphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [4- (propan- 2- yl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C

STK594423
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (4- ethoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- ethylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2CC)nnc1COc1ccc(cc1)Cl

STK594424
Synonyms: 2- [6- (propan- 2- yl)- 1,3- benzothiazol- 2- yl]- 1- (pyridin- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CC(c1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccnc1)c(=O)c1c(o2)cccc1)C

STK594425
Synonyms: (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl){4- [(methylsulfanyl)methyl]phenyl}methanone
Smiles: CSCc1ccc(cc1)C(=O)N1CCc2c(C1)cc(c(c2)OC)OC

STK594427
Synonyms: N- (3,5- dichlorophenyl)- 2- {[4- phenyl- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)cc(c1)Cl)CSc1nnc(n1c1ccccc1)c1cnccn1

STK594428
Synonyms: 5- hydroxy- 7,7- dimethyl- N- (2- methyl- 4- nitrophenyl)- 2- oxo- 2,3,4,6,7,8- hexahydroquinoline- 4- carboxamide
Smiles: O=C1N=C2CC(C)(C)CC(=C2C(C1)C(=O)Nc1ccc(cc1C)[N+](=O)[O-])O

STK594429
Synonyms: N- {(1Z)- 1- [2- (butylamino)- 1- cyano- 2- oxoethylidene]- 1H- isoindol- 3- yl}- 3,4,5- trimethoxybenzamide
Smiles: CCCCNC(=O)/C(=C/1\N=C(c2c1cccc2)NC(=O)c1cc(OC)c(c(c1)OC)OC)/C#N

STK594430
Synonyms: 5- [2- (3,4- dimethoxyphenyl)ethyl]- 1- phenyl- 1,5- dihydro- 4H- pyrazolo[3,4- d]pyrimidin- 4- one
Smiles: COc1cc(ccc1OC)CCn1cnc2c(c1=O)cnn2c1ccccc1

STK594431
Synonyms: 4- (4- chlorophenyl)- 3- [(2,6- dichlorobenzyl)sulfanyl]- 5- (phenoxymethyl)- 4H- 1,2,4- triazole
Smiles: Clc1ccc(cc1)n1c(COc2ccccc2)nnc1SCc1c(Cl)cccc1Cl

STK594432
Synonyms: 2- {ethyl[5- (2- methylpropyl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinolin- 8- yl]amino}ethanol
Smiles: OCCN(c1ncnc2c1oc1c2c2CCCCc2c(n1)CC(C)C)CC

STK594433
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)- 3- (2,4- dimethoxyphenyl)- 6- [2- (dimethylamino)ethyl]- 4a,7a,8,8a- tetrahydro- 3aH- 4,8- methano[1,2]oxazolo[4,5- f]isoindole- 5,7(4H,6H)- dione
Smiles: COc1cc(OC)ccc1C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)CCN(C)C

STK594434
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,3- dimethylphenyl)acetamide
Smiles: Clc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1cccc(c1C)C

STK594435
Synonyms: methylN- {(E)- [1- (2,5- dimethoxyphenyl)- 2- hydroxy- 4,6- dioxo- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}tryptophanate
Smiles: COC(=O)C(Cc1c[nH]c2c1cccc2)N/C=C/1\C(=O)N=C(N(C1=O)c1cc(OC)ccc1OC)O

STK594436
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- 1,3- benzodioxol- 5- ylmethylidene]- 5- (4- propoxyphenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc2c(c1)OCO2

STK594437
Synonyms: 12,12- dimethyl- 7- (propylsulfanyl)- 12,13- dihydro- 10H- pyrano[4',3':4,5]thieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidine
Smiles: CCCSc1nnc2n1c1sc3c(c1c1n2ncn1)CC(OC3)(C)C

STK594438
Synonyms: N- (6- chloro- 4- oxo- 3- phenyl- 4H- chromen- 2- yl)benzamide
Smiles: Clc1ccc2c(c1)c(=O)c(c(o2)NC(=O)c1ccccc1)c1ccccc1

STK594439
Synonyms: 2- ({4- (4- ethoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- methylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C)nnc1COc1ccc(cc1)C

STK594440
Synonyms: 9- (4- fluorophenyl)- 6- phenyl- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Fc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1

STK594442
Synonyms: N- [(2Z)- 3- [2- (4- fluorophenyl)ethyl]- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]cyclopropanecarboxamide
Smiles: Fc1ccc(cc1)CCN1/C(=N/C(=O)C2CC2)/SC2C1CS(=O)(=O)C2

STK594443
Synonyms: 2- ({4- amino- 5- [5- (4- chlorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (5- chloro- 2- methylphenyl)acetamide
Smiles: O=C(Nc1cc(Cl)ccc1C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK594444
Synonyms: (5s,7s)- 2- (5- bromo- 2- methoxyphenyl)- 5- methyl- 7- phenyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: COc1ccc(cc1C1N2C[C@@]3(CN1C[C@](C2)(C3=O)c1ccccc1)C)Br

STK594445
Synonyms: 6- benzyl- 1- (4- methoxyphenyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: COc1ccc(cc1)n1c(S)nc(=O)c2c1NCN(C2)Cc1ccccc1

STK594446
Synonyms: 3- [(2,6- dichlorobenzyl)sulfanyl]- 4- (4- ethoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazole
Smiles: CCOc1ccc(cc1)n1c(COc2ccccc2)nnc1SCc1c(Cl)cccc1Cl

STK594448
Synonyms: 4- {[(E)- (2- chloro- 6- fluorophenyl)methylidene]amino}- 5- (3,4,5- trimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1c(OC)cc(cc1OC)c1n[nH]c(=S)n1/N=C/c1c(F)cccc1Cl

STK594452
Synonyms: 2- [(4,7- dimethyl- 2- oxo- 2H- chromen- 5- yl)oxy]- N- [2- (morpholin- 4- yl)ethyl]acetamide
Smiles: O=C(COc1cc(C)cc2c1c(C)cc(=O)o2)NCCN1CCOCC1

STK594453
Synonyms: 5,10,10- trimethyl- N- (2- phenylethyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: O=C(c1nn2c(n1)c1c(nc2C)sc2c1CC(C)(C)OC2)NCCc1ccccc1

STK594454
Synonyms: 10,10- dimethyl- 2- (4- nitrophenyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: [O-][N+](=O)c1ccc(cc1)c1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

STK594455
Synonyms: N- (3,4- dimethylphenyl)- 2,2- dimethyl- N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]propanamide
Smiles: Cc1cc(ccc1C)N(C(=O)C(C)(C)C)Cc1cc2cccc(c2[nH]c1=O)C

STK594456
Synonyms: N- [(2Z)- 3- (1,3- benzodioxol- 5- yl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- phenylacetamide
Smiles: O=C(/N=C/1\SC2C(N1c1ccc3c(c1)OCO3)CS(=O)(=O)C2)Cc1ccccc1

STK594457
Synonyms: 3- (4- chlorophenyl)- 5- (4- methoxyphenyl)- 2- methylpyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: COc1ccc(cc1)c1cc(O)n2c(n1)c(c1ccc(cc1)Cl)c(n2)C

STK594458
Synonyms: N- (2- chlorophenyl)- 1- (4- ethylphenyl)- 4- phenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1Cl)cc3c1ccccc1

STK594460
Synonyms: 2- {[3- (3- chlorophenyl)- 7- methyl- 4- oxo- 3,4,5,6,7,8- hexahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- (tetrahydrofuran- 2- ylmethyl)acetamide
Smiles: CN1CCc2c(C1)sc1c2c(=O)n(c(n1)SCC(=O)NCC1CCCO1)c1cccc(c1)Cl

STK594462
Synonyms: 2- {[4- (4- methylphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (naphthalen- 2- yl)ethanone
Smiles: Cc1ccc(cc1)n1c(SCC(=O)c2ccc3c(c2)cccc3)nnc1Cc1cccs1

STK594465
Synonyms: 4- chloro- N- [(3Z)- 6- methyl- 1- propyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]benzenesulfonamide
Smiles: CCCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)Cl)/c2c1nc1ccc(cc1c2)C

STK594466
Synonyms: 2- {[3- cyano- 5- hydroxy- 4- (4- methoxyphenyl)- 7,7- dimethyl- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- (4- ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C2=C(CC(CC2=N1)(C)C)O)c1ccc(cc1)OC

STK594467
Synonyms: (E)- {2- [3- (benzyloxy)phenyl]- 1- [2- (morpholin- 4- ium- 4- yl)ethyl]- 4,5- dioxopyrrolidin- 3- ylidene}(2,3- dihydro- 1,4- benzodioxin- 6- yl)methanolate
Smiles: [O-]/C(=C\1/C(=O)C(=O)N(C1c1cccc(c1)OCc1ccccc1)CC[NH+]1CCOCC1)/c1ccc2c(c1)OCCO2

STK594468
Synonyms: 3- [(3a'S,6a'R)- 6- chloro- 5'- (3- chloro- 4- fluorophenyl)- 7- methyl- 2,4',6'- trioxo- 1,2,3',3a',4',5',6',6a'- octahydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 3'- yl]propanamide
Smiles: NC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(c(c1)Cl)F)C(=O)Nc1c2ccc(c1C)Cl

STK594469
Synonyms: 8- {[butyl(methyl)ammonio]methyl}- 3- (3,4- dimethoxyphenyl)- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- olate
Smiles: CCCC[NH+](Cc1c([O-])ccc2c1oc(c(c2=O)c1ccc(c(c1)OC)OC)C(F)(F)F)C

STK594470
Synonyms: N- (3,4- dimethylphenyl)- 2- ({4- (furan- 2- ylmethyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)C)C)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK594471
Synonyms: 2- (4- ethoxyphenyl)- 4- imino- 6,7,11,12- tetrahydro- 4H,10H- [1,4]dioxepino[2,3- g]pyrido[2,1- a]isoquinoline- 3- carbonitrile
Smiles: CCOc1ccc(cc1)c1cc2c3cc4OCCCOc4cc3CCn2c(=N)c1C#N

STK594474
Synonyms: 7- chloro- 2- (4,6- dimethyl- 1,3- benzothiazol- 2- yl)- 1- (3- hydroxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Oc1cccc(c1)C1N(c2nc3c(s2)cc(cc3C)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK594475
Synonyms: (5E)- 6- hydroxy- 3- (4- methoxyphenyl)- 5- ({[2- (morpholin- 4- yl)ethyl]amino}methylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C\NCCN2CCOCC2)/C1=O)O

STK594477
Synonyms: 2- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 5,6,7,8- tetrahydroquinazolin- 4- ol
Smiles: Oc1nc(nc2c1CCCC2)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK594479
Synonyms: N,N'- (octane- 1,8- diyldi- 1,3,4- thiadiazol- 2- yl- 5- ylidene)diacetamide
Smiles: CC(=O)/N=c\1/[nH]nc(s1)CCCCCCCCc1n[nH]/c(=N/C(=O)C)/s1

STK594480
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(3,4- dimethoxyphenyl)carbonyl]- 2'- (furan- 2- ylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1cc(ccc1OC)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccco1)C(=O)Nc1c2cccc1)cccc3

STK594481
Synonyms: 6- hydroxy- 3- methyl- 7- (prop- 2- en- 1- yl)- 8- (prop- 2- en- 1- ylsulfanyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: C=CCn1c(SCC=C)nc2c1c(O)nc(=O)n2C

STK594482
Synonyms: (2E)- N- [(2E)- 1,3- benzothiazol- 2(3H)- ylidene]- 3- (2- chlorophenyl)prop- 2- enamide
Smiles: O=C(/N=c\1/sc2c([nH]1)cccc2)/C=C/c1ccccc1Cl

STK594483
Synonyms: 1- ({1- [(4- methylphenyl)sulfonyl]piperidin- 4- yl}carbonyl)- N- (tetrahydrofuran- 2- ylmethyl)- L- prolinamide
Smiles: O=C([C@@H]1CCCN1C(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)NCC1CCCO1

STK594488
Synonyms: 6- (2- chlorobenzyl)- 1- (2,3- dimethylphenyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: Sc1nc(=O)c2c(n1c1cccc(c1C)C)NCN(C2)Cc1ccccc1Cl

STK594489
Synonyms: 2- ({4- amino- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- 1- (10H- phenothiazin- 10- yl)ethanone
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)N1c2ccccc2Sc2c1cccc2

STK594490
Synonyms: 8- (2- fluorophenyl)- 9- (5- methyl- 1,2- oxazol- 3- yl)- 8,9- dihydrobenzo[7,8]chromeno[2,3- c]pyrrole- 7,10- dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccccc1F)c(=O)c1c(o2)c2ccccc2cc1

STK594493
Synonyms: 6'- chloro- 7'- [(Z)- (4- hydroxy- 1- methyl- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene)methyl]- 1,3- dimethyl- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- trion
Smiles: O=C1N=C(O)/C(=C/c2ccc3c(c2Cl)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C(=O)N1C

STK594494
Synonyms: 4- chloro- N- [(6- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (2- methoxyphenyl)benzenesulfonamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)c1ccc(cc1)Cl)c1ccccc1OC

STK594495
Synonyms: 2- {[5- (2- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [4- (diethylamino)phenyl]acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1Cc1ccco1)c1ccccc1Cl)CC

STK594496
Synonyms: 7- [(4- chlorobenzyl)sulfanyl]- 2,12,12- trimethyl- 12,13- dihydro- 10H- pyrano[4',3':4,5]thieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidine
Smiles: Clc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c1n2nc(n1)C)CC(OC3)(C)C

STK594497
Synonyms: 3- [(3,4- dichlorobenzyl)sulfanyl]- 5- (3- methoxyphenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazole
Smiles: COc1ccc(cc1)n1c(SCc2ccc(c(c2)Cl)Cl)nnc1c1cccc(c1)OC

STK594499
Synonyms: 4- {[(E)- (5- bromo- 2- fluorophenyl)methylidene]amino}- 5- (pyridin- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Brc1ccc(c(c1)/C=N/n1c(=S)[nH]nc1c1ccccn1)F

STK594502
Synonyms: methylN- [(2- chlorophenyl)carbamoyl]- D- phenylalaninate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccccc1Cl)Cc1ccccc1

STK594503
Synonyms: methylN- (piperidin- 1- ylcarbonyl)- L- alaninate
Smiles: COC(=O)[C@@H](NC(=O)N1CCCCC1)C

STK594504
Synonyms: (3Z)- 4- imino- 7,8- dimethyl- 3- [(5- nitrofuran- 2- yl)methylidene]- 3,4- dihydro- 2H- pyrimido[2,1- b][1,3]benzothiazol- 2- one
Smiles: O=C1N=c2sc3c(n2C(=N)/C/1=C/c1ccc(o1)[N+](=O)[O-])cc(c(c3)C)C

STK594506
Synonyms: 1- benzyl- 6- (butan- 2- yl)- 2- hydroxy- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: CCC(N1CNc2c(C1)c(=O)nc(n2Cc1ccccc1)O)C

STK594508
Synonyms: N- (2,3- dimethylphenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1cccc(c1C)C

STK594509
Synonyms: (5Z)- 6- hydroxy- 3- (2- methylphenyl)- 5- (1- {[3- (trifluoromethyl)phenyl]amino}ethylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C(/Nc2cccc(c2)C(F)(F)F)\C)/C(=O)N1c1ccccc1C

STK594510
Synonyms: 2- {8,9- diphenyl- 2- [({[(E)- phenylmethylidene]amino}oxy)methyl]- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 7- yl}ethanol
Smiles: OCCn1c(c2ccccc2)c(c2c1ncn1c2nc(n1)CO/N=C/c1ccccc1)c1ccccc1

STK594511
Synonyms: (3aR,6aS)- 3- (4- chlorophenyl)- 5- (2,5- dimethoxyphenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: COc1ccc(cc1N1C(=O)[C@@H]2[C@H](C1=O)C(=NO2)c1ccc(cc1)Cl)OC

STK594513
Synonyms: N- phenyl- 3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline- 8(7H)- carbothioamide
Smiles: S=C(N1CCc2c(C1)cc1c(c2)OCCCO1)Nc1ccccc1

STK594514
Synonyms: 1- (3- ethoxy- 4- hydroxyphenyl)- 2- (6- fluoro- 1,3- benzothiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1cc(ccc1O)C1N(c2nc3c(s2)cc(cc3)F)C(=O)c2c1c(=O)c1c(o2)cccc1

STK594515
Synonyms: (2E)- 2- (4- hydroxyquinazolin- 2(1H)- ylidene)- 3- (4- nitrophenyl)- 3- oxopropanenitrile
Smiles: N#C/C(=c/1\nc(O)c2c([nH]1)cccc2)/C(=O)c1ccc(cc1)[N+](=O)[O-]

STK594516
Synonyms: 4- ({(E)- [4- (benzyloxy)phenyl]methylidene}amino)- 5- (3- chlorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)OCc1ccccc1

STK594517
Synonyms: (E)- {2- (3- chlorophenyl)- 1- [2- (morpholin- 4- ium- 4- yl)ethyl]- 4,5- dioxopyrrolidin- 3- ylidene}[3- fluoro- 4- (propan- 2- yloxy)phenyl]methanolate
Smiles: Clc1cccc(c1)C1/C(=C(/c2ccc(c(c2)F)OC(C)C)\[O-])/C(=O)C(=O)N1CC[NH+]1CCOCC1

STK594518
Synonyms: [4- (3- chlorophenyl)piperazin- 1- yl](5- fluoro- 1H- indol- 2- yl)methanone
Smiles: Fc1ccc2c(c1)cc([nH]2)C(=O)N1CCN(CC1)c1cccc(c1)Cl

STK594520
Synonyms: 1- (4- ethoxyphenyl)- N,4- bis(4- methoxyphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCOc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccc(cc1)OC)cc3c1ccc(cc1)OC

STK594522
Synonyms: 5- (3- ethoxyphenyl)- 4- {[(E)- (4- methylphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C

STK594524
Synonyms: 3- cyclopentyl- 10- methyl- 2- (propan- 2- yl)pyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: O=c1n(C2CCCC2)c(nc2c1c(=O)c1ccccc1n2C)C(C)C

STK594525
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(2,4- dichlorophenyl)carbonyl]- 2'- [(3- nitrophenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Clc1ccc(c(c1)Cl)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccc(c1)[N+](=O)[O-])C(=O)Nc1c2cccc1)cccc3

STK594527
Synonyms: 4- (naphthalen- 1- yl)- 2- phenyl- 4,6,7,8- tetrahydro- 2H- pyrazolo[3,4- b]quinoline- 3,5- diol
Smiles: OC1=C2C(=Nc3c(C2c2cccc4c2cccc4)c(O)n(n3)c2ccccc2)CCC1

STK594528
Synonyms: (4- fluorophenyl)[11- (furan- 2- yl)- 1- hydroxy- 3- methyl- 2,3,4,11- tetrahydro- 10H- dibenzo[b,e][1,4]diazepin- 10- yl]methanone
Smiles: CC1CC(=C2C(=Nc3ccccc3N(C2c2ccco2)C(=O)c2ccc(cc2)F)C1)O

STK594529
Synonyms: [4- (3- chlorophenyl)piperazin- 1- yl](5,6- dimethoxy- 1H- indol- 2- yl)methanone
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)N1CCN(CC1)c1cccc(c1)Cl

STK594530
Synonyms: N- [(2E)- 6- chloro- 4- phenylquinazolin- 2(1H)- ylidene]- 5- (2- phenylethyl)- 1,4,5,6- tetrahydro- 1,3,5- triazin- 2- amine
Smiles: Clc1ccc2c(c1)c(n/c(=N/C1=NCN(CN1)CCc1ccccc1)/[nH]2)c1ccccc1

STK594531
Synonyms: 10- methyl- 2- phenyl- 3- propylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: CCCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccccc1

STK594532
Synonyms: methyl[(2Z)- 5- (4- methoxybenzyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]carbamate
Smiles: COc1ccc(cc1)Cc1n[nH]/c(=N/C(=O)OC)/s1

STK594533
Synonyms: 1'- butyl- 6- hydroxy- 3- (4- methylphenyl)- 6'- nitro- 2'- propyl- 1',4'- dihydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinoline]- 2,4(3H)- dione
Smiles: CCCC1N(CCCC)c2ccc(cc2CC21C(=NC(=O)N(C2=O)c1ccc(cc1)C)O)[N+](=O)[O-]

STK594534
Synonyms: 1,3- dimethyl- 8- [(4- methylpiperidin- 1- yl)methyl]- 7- (3- phenylpropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC1CCN(CC1)Cc1nc2c(n1CCCc1ccccc1)c(=O)n(c(=O)n2C)C

STK594535
Synonyms: 2- {[5- (2- chlorophenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [4- chloro- 2- (trifluoromethyl)phenyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2C(F)(F)F)Cl)nnc1c1ccccc1Cl

STK594536
Synonyms: (4Z)- 4- [(2,4- dimethylphenyl)imino]- 6- {[4- (4- methoxyphenyl)piperazin- 1- yl]methyl}- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1nc(N)n/c(=N\c2ccc(cc2C)C)/[nH]1

STK594537
Synonyms: (2- chloro- 6- fluorophenyl)(5- methylidene- 7,8- dihydro[1,3]dioxolo[4,5- g]isoquinolin- 6(5H)- yl)methanone
Smiles: C=C1c2cc3OCOc3cc2CCN1C(=O)c1c(F)cccc1Cl

STK594538
Synonyms: N- (2- methylphenyl)- 2- {[4- (4- methylphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK594540
Synonyms: N- [3- (3- methoxyphenyl)- 1- methyl- 4- oxo- 1,4- dihydroquinolin- 2- yl]acetamide
Smiles: COc1cccc(c1)c1c(NC(=O)C)n(C)c2c(c1=O)cccc2

STK594541
Synonyms: (3R,3'S,5'R)- 5- chloro- N- (4- methoxyphenyl)- 7- methyl- 2- oxo- 5'- (propan- 2- yl)- 1,2- dihydrospiro[indole- 3,2'- pyrrolidine]- 3'- carboxamide
Smiles: COc1ccc(cc1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(Cl)cc1C)C(C)C

STK594542
Synonyms: 4- {[(E)- (3- bromo- 4- methoxyphenyl)methylidene]amino}- 5- (4- fluorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1Br)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)F

STK594543
Synonyms: 2,2- dimethyl- 5- (propan- 2- yl)- N- (pyridin- 4- ylmethyl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8- amine
Smiles: CC(c1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCc1ccncc1)C

STK594545
Synonyms: 3- {1- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 1- oxobutan- 2- yl}- 1,2,3- benzotriazin- 4(3H)- one
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK594547
Synonyms: (3S)- N- {(2S)- 1- [(3,4- dimethylphenyl)amino]- 1- oxopropan- 2- yl}- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: C[C@@H](C(=O)Nc1ccc(c(c1)C)C)NC(=O)[C@H]1NCc2c(C1)cccc2

STK594548
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)- 3- (4- chlorophenyl)- 6- [2- (dimethylamino)ethyl]- 4a,7a,8,8a- tetrahydro- 3aH- 4,8- methano[1,2]oxazolo[4,5- f]isoindole- 5,7(4H,6H)- dione
Smiles: CN(CCN1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1C[C@H]2[C@H]2[C@@H]1ON=C2c1ccc(cc1)Cl)C

STK594550
Synonyms: N- [(1- ethylpyrrolidin- 2- yl)methyl]- 4,5,6- trimethoxy- 1H- indole- 2- carboxamide
Smiles: CCN1CCCC1CNC(=O)c1cc2c([nH]1)cc(c(c2OC)OC)OC

STK594552
Synonyms: N- [5- (dimethylsulfamoyl)- 2- methylphenyl]- 4,7,7- trimethyl- 2,3- dioxobicyclo[2.2.1]heptane- 1- carboxamide
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1=O)C)Nc1cc(ccc1C)S(=O)(=O)N(C)C

STK594553
Synonyms: 6- hydroxy- 3- methyl- 7- {3- [(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]propyl}- 8- (morpholin- 4- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: Cc1nnc(s1)SCCCn1c(nc2c1c(O)nc(=O)n2C)N1CCOCC1

STK594555
Synonyms: N- [(2E)- 3- benzyl- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- (2- methoxyphenyl)acetamide
Smiles: COc1ccccc1CC(=O)/N=C\1/SC2C(N1Cc1ccccc1)CS(=O)(=O)C2

STK594557
Synonyms: 7- fluoro- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- (2,3,4- trimethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1c(ccc(c1OC)OC)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK594558
Synonyms: N,1- dibenzyl- N- butyl- 9- methyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: CCCCN(C(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C)Cc1ccccc1

STK594560
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)Cl

STK594561
Synonyms: 4- amino- 7'- methyl- 2'- oxo- 1',2',6,7,11,12- hexahydro- 10H- spiro[1,4- dioxepino[2,3- g]pyrido[2,1- a]isoquinoline- 2,3'- indole]- 3- carbonitrile
Smiles: N#CC1=C(N)N2CCc3c(C2=CC21C(=O)Nc1c2cccc1C)cc1c(c3)OCCCO1

STK594562
Synonyms: 3- [(5Z)- 5- {2- [(2- chlorobenzyl)oxy]- 5- nitrobenzylidene}- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoicacid
Smiles: OC(=O)CCN1C(=S)S/C(=C\c2cc(ccc2OCc2ccccc2Cl)[N+](=O)[O-])/C1=O

STK594563
Synonyms: N'- [(E)- quinoxalin- 2- ylmethylidene]pyridine- 4- carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1cnc2c(n1)cccc2

STK594564
Synonyms: N- (2- methoxyethyl)- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]thiophene- 2- carboxamide
Smiles: COCCN(C(=O)c1cccs1)Cc1cc2ccccc2[nH]c1=O

STK594565
Synonyms: 9- (4- hydroxy- 3- methoxyphenyl)- 6- (4- methoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2ccc(c(c2)OC)O)ncn3)C1)O

STK594566
Synonyms: N- [2- (pyrrolidin- 1- yl)phenyl]- 4,5,6,7- tetrahydro- 2H- indazole- 3- carboxamide
Smiles: O=C(c1[nH]nc2c1CCCC2)Nc1ccccc1N1CCCC1

STK594567
Synonyms: N- {(1Z)- 1- [1- cyano- 2- oxo- 2- (phenylamino)ethylidene]- 1H- isoindol- 3- yl}benzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccccc1)/C(=O)Nc1ccccc1

STK594569
Synonyms: 3- (diphenylmethyl)- 1',3'- dimethyl- 8- nitro- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1cc(ccc1N1C2CN(CC1)C(c1ccccc1)c1ccccc1)[N+](=O)[O-]

STK594570
Synonyms: 8- chloro- N- cyclohexyl[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: Clc1ccc2c(c1)c1ncnc(c1o2)NC1CCCCC1

STK594572
Synonyms: N'- [(E)- (2- chloro- 6- methoxyquinolin- 3- yl)methylidene]- 4- methylbenzenesulfonohydrazide
Smiles: COc1ccc2c(c1)cc(c(n2)Cl)/C=N/NS(=O)(=O)c1ccc(cc1)C

STK594573
Synonyms: 3- (1,3- benzothiazol- 2- ylamino)- 6,7- dimethoxy- 2- benzofuran- 1(3H)- one
Smiles: COc1c(OC)ccc2c1C(=O)OC2Nc1nc2c(s1)cccc2

STK594576
Synonyms: 10- methyl- 8- phenyl- 11- (pyridin- 3- yl)- 2- (thiophen- 2- yl)- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1nn(c2c1C(c1cccnc1)c1c(O2)ncn2c1nc(n2)c1cccs1)c1ccccc1

STK594577
Synonyms: 5- (3- methoxyphenyl)- 4- {[(E)- (4- methylphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C

STK594578
Synonyms: 7- ethyl- 6- hydroxy- 3- methyl- 8- [4- (naphthalen- 1- ylmethyl)piperazin- 1- yl]- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1cccc2c1cccc2

STK594579
Synonyms: N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (2- methylpropyl)pyridine- 4- carboxamide
Smiles: CC(CN(C(=O)c1ccncc1)Cc1cc2cc(C)ccc2[nH]c1=O)C

STK594580
Synonyms: 1',3',12- trimethyl- 2,3,4,4a- tetrahydro- 1H,2'H,6H,7H- spiro[pyrido[1',2':1,2]pyrimido[5,4- c]quinolizine- 5,5'- pyrimidine]- 2',4',6',7(1'H,3'H)- tetrone
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1c(N3C2CCCC3)nc2n(c1=O)cccc2C

STK594581
Synonyms: (4E)- 1- {5- [(2- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- [4- (propan- 2- yl)phenyl]pyrrolidine- 2,3- dione
Smiles: O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C(N1c1nnc(s1)SCc1ccccc1Cl)c1ccc(cc1)C(C)C

STK594583
Synonyms: 1- (4- chlorophenyl)- 4- (4- fluorophenyl)- N- (3- methoxyphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1cccc(c1)NC(=O)c1n2cc(n3c2c(c1c1ccc(cc1)Cl)CCCC3)c1ccc(cc1)F

STK594584
Synonyms: 2- [3- (7- amino- 6- cyano- 4- hydroxy- 5H- pyrano[2,3- d]pyrimidin- 5- yl)phenoxy]acetamide
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1)OCC(=O)N)c(O)ncn2

STK594585
Synonyms: (5E)- 5- {[5- (2,4- dichlorophenyl)- 1H- pyrrol- 2- yl]methylidene}- 2,6- dihydroxypyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)/C(=C/c2ccc([nH]2)c2ccc(cc2Cl)Cl)/C(=N1)O

STK594587
Synonyms: 4- (4- chlorophenyl)- 3- [(2,6- dichlorobenzyl)sulfanyl]- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazole
Smiles: Clc1ccc(cc1)n1c(nnc1SCc1c(Cl)cccc1Cl)COc1ccc(cc1)C

STK594588
Synonyms: N- [(2Z)- 3- benzyl- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 3- cyclopentylpropanamide
Smiles: O=C(/N=C/1\SC2C(N1Cc1ccccc1)CS(=O)(=O)C2)CCC1CCCC1

STK594589
Synonyms: 1- (4- hydroxyphenyl)- 2- (6- methyl- 1,3- benzothiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Oc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK594590
Synonyms: 2- [(6- methyl- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- yl)oxy]- N- (pyridin- 3- ylmethyl)propanamide
Smiles: O=C(C(Oc1ccc2c(c1C)oc(=O)c1c2CCC1)C)NCc1cccnc1

STK594591
Synonyms: 7- (2- chloro- 6- fluorobenzyl)- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 6(7H)- one
Smiles: Fc1cccc(c1Cn1c2ccccc2c2c1c(=O)n1c(n2)SCCC1)Cl

STK594594
Synonyms: 4- (2,4- dichlorophenoxy)- N- [(2E)- 5- methyl- 1,3,4- thiadiazol- 2(3H)- ylidene]butanamide
Smiles: Clc1ccc(c(c1)Cl)OCCCC(=O)/N=c/1\[nH]nc(s1)C

STK594595
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)- 6- tert- butyl- 3- (2,4- dimethoxyphenyl)- 4a,7a,8,8a- tetrahydro- 3aH- 4,8- methano[1,2]oxazolo[4,5- f]isoindole- 5,7(4H,6H)- dione
Smiles: COc1cc(OC)ccc1C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)C(C)(C)C

STK594596
Synonyms: (5E)- 3- benzyl- 5- {1- [(furan- 2- ylmethyl)amino]propylidene}- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)O)/NCc1ccco1

STK594597
Synonyms: 2- [(2E)- (2- chloro- 6- fluorobenzylidene)hydrazinylidene]- 2,3- dihydro- 1H- benzimidazole
Smiles: Fc1cccc(c1/C=N/N=c/1\[nH]c2c([nH]1)cccc2)Cl

STK594598
Synonyms: 4- ({(E)- [3- (benzyloxy)phenyl]methylidene}amino)- 5- (4- ethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1cccc(c1)OCc1ccccc1

STK594599
Synonyms: 2- ({4- (4- ethoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3- methoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)OC)nnc1COc1ccc(cc1)C

STK594600
Synonyms: 1- [11- (furan- 2- yl)- 1- hydroxy- 3,3- dimethyl- 2,3,4,11- tetrahydro- 10H- dibenzo[b,e][1,4]diazepin- 10- yl]propan- 1- one
Smiles: CCC(=O)N1C(c2ccco2)C2=C(O)CC(CC2=Nc2c1cccc2)(C)C

STK594601
Synonyms: 3,4,5- trimethoxy- N- (1- methyl- 4- oxo- 3- phenyl- 1,4- dihydroquinolin- 2- yl)benzamide
Smiles: COc1c(OC)cc(cc1OC)C(=O)Nc1n(C)c2ccccc2c(=O)c1c1ccccc1

STK594602
Synonyms: N- [4- (4- methoxyphenyl)- 6- methyl- 2- (4- methylphenyl)- 5- oxo- 2,5- dihydropyridazin- 3- yl]cyclohexanecarboxamide
Smiles: COc1ccc(cc1)c1c(NC(=O)C2CCCCC2)n(nc(c1=O)C)c1ccc(cc1)C

STK594605
Synonyms: N- [2- (6- methyl[1,2,4]triazolo[3,4- a]phthalazin- 3- yl)phenyl]- 3- nitrobenzamide
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])Nc1ccccc1c1nnc2n1nc(C)c1c2cccc1

STK594606
Synonyms: 9- tert- butyl- N- [3- (dimethylamino)propyl]- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CN(CCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CCC(C2)C(C)(C)C)C

STK594607
Synonyms: N- (3,4- dimethoxybenzyl)- 5,6- dimethoxy- N- (prop- 2- en- 1- yl)- 1H- indole- 2- carboxamide
Smiles: C=CCN(C(=O)c1cc2c([nH]1)cc(c(c2)OC)OC)Cc1ccc(c(c1)OC)OC

STK594608
Synonyms: 2- (10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidin- 7- ylsulfanyl)- N- (1,3- thiazol- 2- yl)acetamide
Smiles: O=C(Nc1nccs1)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CCCC3

STK594610
Synonyms: 7- (2- methoxyphenyl)- 9- phenylthieno[2,3- b:4,5- b']dipyridine- 2,4- diol
Smiles: COc1ccccc1c1nc2sc3c(c2c(c1)c1ccccc1)nc(cc3O)O

STK594611
Synonyms: 3- (pyridin- 2- yl)- 3,4- dihydro- 2H,6H- benzo[3,4]chromeno[8,7- e][1,3]oxazin- 6- one
Smiles: O=c1oc2c3CN(COc3ccc2c2c1cccc2)c1ccccn1

STK594613
Synonyms: (E)- {1- [2- (diethylammonio)ethyl]- 2- (4- fluorophenyl)- 4,5- dioxopyrrolidin- 3- ylidene}(4- nitrophenyl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/[O-])/C1c1ccc(cc1)F)CC

STK594614
Synonyms: 3- (3- bromo- 4- fluorophenyl)- 5- (4- methylphenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccc(c(c1)Br)F

STK594615
Synonyms: (4E)- 2- (2- fluorophenyl)- 4- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: O=C1/C(=C/NCCCN2CCOCC2)/c2ccccc2C(=O)N1c1ccccc1F

STK594619
Synonyms: 4- ({(E)- [3- (benzyloxy)- 4- methoxyphenyl]methylidene}amino)- 5- (3,4,5- trimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1OCc1ccccc1)/C=N/n1c(=S)[nH]nc1c1cc(OC)c(c(c1)OC)OC

STK594620
Synonyms: 2- (2,4- dichlorophenyl)- 8- methoxy- 3- (3- methoxypropyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COCCCn1c(nc2c(c1=O)c(=O)c1c(o2)cc(cc1)OC)c1ccc(cc1Cl)Cl

STK594621
Synonyms: 2- (4- chloro- 3- methylphenoxy)- 1- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)ethanone
Smiles: COc1cc2CCN(Cc2cc1OC)C(=O)COc1ccc(c(c1)C)Cl

STK594622
Synonyms: (3a'S,6a'R)- 5- bromo- 5'- butyl- 3'- (4- hydroxybenzyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cc(Br)cc2

STK594625
Synonyms: (3a'S,6a'R)- 5'- (4- ethylphenyl)- 5- fluoro- 3'- (4- hydroxybenzyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CCc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cc(F)cc2

STK594626
Synonyms: 6- chloro- 8- [(2,6- dimethylmorpholin- 4- ium- 4- yl)methyl]- 4- methyl- 2- oxo- 2H- chromen- 7- olate
Smiles: CC1C[NH+](CC(O1)C)Cc1c([O-])c(Cl)cc2c1oc(=O)cc2C

STK594628
Synonyms: 6- butyl- 1- (6- methylpyridin- 2- yl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: CCCCN1CNc2c(C1)c(=O)nc(n2c1cccc(n1)C)S

STK594629
Synonyms: N- (2- ethoxyphenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccccc1NC(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)OC

STK594630
Synonyms: 2- methyl- 3- (3- methylbutyl)pyrimido[1,2- a]benzimidazol- 4- ol
Smiles: CC(CCc1c(C)nc2n(c1O)c1ccccc1n2)C

STK594632
Synonyms: N- (2- methylphenyl)- 2- (10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidin- 7- ylsulfanyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CCCC3

STK594633
Synonyms: 2,6- dimethyl- 4- phenylpyridazino[3',4':4,5]pyrimido[1,6- a]benzimidazol- 1(4H)- one
Smiles: Cc1nn(c2ccccc2)c2c(c1=O)c1nc3c(n1c(n2)C)cccc3

STK594634
Synonyms: methylN- {[2- (4- methoxyphenyl)ethyl]carbamoyl}- D- alaninate
Smiles: COC(=O)[C@H](NC(=O)NCCc1ccc(cc1)OC)C

STK594636
Synonyms: 2- [(3aR,4R,4aR,7aS,8R,8aR)- 3- (4- methoxyphenyl)- 5,7- dioxo- 3a,4,4a,5,7,7a,8,8a- octahydro- 6H- 4,8- methano[1,2]oxazolo[4,5- f]isoindol- 6- yl]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: COc1ccc(cc1)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1sc2c(c1C#N)CCCC2

STK594637
Synonyms: (5E)- 3- (4- bromophenyl)- 5- {[1- (2- chlorobenzyl)- 2,3- dihydro- 1H- indol- 5- yl]methylidene}- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: Brc1ccc(cc1)N1C(=O)N=C(/C(=C\c2ccc3c(c2)CCN3Cc2ccccc2Cl)/C1=O)O

STK594638
Synonyms: methylN- (2,3- dihydro- 1,4- benzodioxin- 6- ylcarbamoyl)- D- alaninate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccc2c(c1)OCCO2)C

STK594639
Synonyms: N- (4- fluorophenyl)- 2- {[4- (4- methoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)F)nnc1c1cccc(c1)C

STK594640
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(2E)- 4- phenylbutan- 2- ylidene]- 5- (4- propoxyphenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C(/CCc1ccccc1)\C

STK594641
Synonyms: 2- {(1E)- 1- [4- hydroxy- 2,6- dioxo- 1- (prop- 2- en- 1- yl)- 1,6- dihydropyrimidin- 5(2H)- ylidene]ethyl}hydrazinecarboxamide
Smiles: C=CCN1C(=O)N=C(/C(=C(\NNC(=O)N)/C)/C1=O)O

STK594645
Synonyms: N,N- dimethyl- 4- {(E)- [2- (5- phenylthieno[2,3- d]pyrimidin- 4- yl)hydrazinylidene]methyl}aniline
Smiles: CN(c1ccc(cc1)/C=N/Nc1ncnc2c1c(cs2)c1ccccc1)C

STK594646
Synonyms: (4- chlorophenyl)(5- methylidene- 7,8- dihydro[1,3]dioxolo[4,5- g]isoquinolin- 6(5H)- yl)methanone
Smiles: Clc1ccc(cc1)C(=O)N1CCc2c(C1=C)cc1c(c2)OCO1

STK594647
Synonyms: (1'R,2'S)- 2'- (2- chlorophenyl)- 1'- [(4- fluorophenyl)carbonyl]- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccccc1Cl)C(=O)c1c(C2=O)cccc1

STK594648
Synonyms: N- cyclopentyl- N~2~- {[1- (4- methoxyphenyl)- 5- oxopyrrolidin- 3- yl]carbonyl}- L- leucinamide
Smiles: COc1ccc(cc1)N1CC(CC1=O)C(=O)N[C@H](C(=O)NC1CCCC1)CC(C)C

STK594649
Synonyms: 2'- amino- 1- (2- chlorobenzyl)- 7'- methyl- 2,5'- dioxo- 1,2- dihydro- 5'H- spiro[indole- 3,4'- pyrano[4,3- b]pyran]- 3'- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31c1ccccc1N(C3=O)Cc1ccccc1Cl)c(=O)oc(c2)C

STK594650
Synonyms: N- [4- (benzyloxy)phenyl]- 2- {[4- methyl- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(n1C)c1cccc(c1)C

STK594651
Synonyms: 7- fluoro- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- [4- (propan- 2- yl)phenyl]- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Fc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccc(cc1)C(C)C)c1noc(c1)C

STK594654
Synonyms: (1Z)- 1- (3,4- dimethoxyphenyl)- N- {[11- (furan- 2- yl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}ethanimine
Smiles: COc1cc(ccc1OC)/C(=N\OCc1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccccc1)/C

STK594655
Synonyms: N- (2,5- dimethoxyphenyl)- 4- [(4- oxoquinazolin- 3(4H)- yl)methyl]cyclohexanecarboxamide
Smiles: COc1ccc(c(c1)NC(=O)C1CCC(CC1)Cn1cnc2c(c1=O)cccc2)OC

STK594656
Synonyms: (1S)- 1- {5- [(2,5- dimethylbenzyl)sulfonyl]- 1,3,4- oxadiazol- 2- yl}ethanamine
Smiles: Cc1ccc(c(c1)CS(=O)(=O)c1nnc(o1)[C@@H](N)C)C

STK594657
Synonyms: 2- ({[4- (4- methoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}methyl)- 1H- benzimidazole
Smiles: COc1ccc(cc1)n1c(SCc2nc3c([nH]2)cccc3)nnc1c1cccc(c1)C

STK594660
Synonyms: (4E)- 5- [3- ethoxy- 4- (3- methylbutoxy)phenyl]- 1- (6- fluoro- 1,3- benzothiazol- 2- yl)- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]pyrrolidine- 2,3- dione
Smiles: CCOc1cc(ccc1OCCC(C)C)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)F

STK594661
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(2- methoxyphenyl)carbonyl]- 3'- [(3- methoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1cccc(c1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1OC)C(=O)Nc1c2cccc1)cccc3

STK594664
Synonyms: 3- (4- methylphenyl)- 2- (thiophen- 2- yl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: Cc1ccc(cc1)n1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1cccs1

STK594666
Synonyms: 1- benzyl- 2- [(4- ethylpiperazin- 1- yl)carbonyl]pyrido[1,2- a]pyrrolo[2,3- d]pyrimidin- 4(1H)- one
Smiles: CCN1CCN(CC1)C(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1

STK594667
Synonyms: 6- [(2- {[(5- methyl- 7- oxo- 3- phenyl- 7H- furo[3,2- g]chromen- 6- yl)acetyl]amino}butanoyl)amino]hexanoicacid
Smiles: CCC(C(=O)NCCCCCC(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccccc1

STK594668
Synonyms: 4- amino- 5'- fluoro- 2'- oxo- 1',2',6,7,11,12- hexahydro- 10H- spiro[1,4- dioxepino[2,3- g]pyrido[2,1- a]isoquinoline- 2,3'- indole]- 3- carbonitrile
Smiles: N#CC1=C(N)N2CCc3c(C2=CC21C(=O)Nc1c2cc(F)cc1)cc1c(c3)OCCCO1

STK594669
Synonyms: 8- {[2- chloro- 5- (trifluoromethyl)phenyl]sulfonyl}- 7- methyl- 3,4,7,8,9,10- hexahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline
Smiles: CC1c2cc3OCCCOc3cc2CCN1S(=O)(=O)c1cc(ccc1Cl)C(F)(F)F

STK594670
Synonyms: (4E)- 4- [hydroxy(4- nitrophenyl)methylidene]- 5- (4- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: O/C(=C\1/C(=O)C(=O)NC1c1ccc(cc1)[N+](=O)[O-])/c1ccc(cc1)[N+](=O)[O-]

STK594671
Synonyms: ethyl1- butyl- 2- ({[4- (dimethylsulfamoyl)phenyl]carbonyl}amino)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCCCn1c2nc3ccccc3nc2c(c1NC(=O)c1ccc(cc1)S(=O)(=O)N(C)C)C(=O)OCC

STK594672
Synonyms: 6,6- dimethyl- 9- (2- nitrophenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: OC1=C2C(=Nc3n(C2c2ccccc2[N+](=O)[O-])ncn3)CC(C1)(C)C

STK594674
Synonyms: 6- hydroxy- 7- [2- hydroxy- 3- (4- methylphenoxy)propyl]- 3- methyl- 8- [(2- phenylethyl)amino]- 3,7- dihydro- 2H- purin- 2- one
Smiles: OC(Cn1c(NCCc2ccccc2)nc2c1c(O)nc(=O)n2C)COc1ccc(cc1)C

STK594677
Synonyms: 2- {[5- (2- chlorophenyl)- 4- (4- chlorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,4- dichlorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccc1Cl

STK594678
Synonyms: 2- [3- (4- methoxyphenyl)- 2,4- dioxo- 3,4,6,7,8,9- hexahydro- 2H- cyclohepta[4,5]thieno[2,3- d]pyrimidin- 1(5H)- yl]acetamide
Smiles: COc1ccc(cc1)n1c(=O)c2c3CCCCCc3sc2n(c1=O)CC(=O)N

STK594679
Synonyms: (8E)- 7- (2- chlorobenzyl)- 1,3- dimethyl- 8- (propan- 2- ylidenehydrazinylidene)- 3,7,8,9- tetrahydro- 1H- purine- 2,6- dione
Smiles: CC(=N/N=c/1\[nH]c2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C)C

STK594680
Synonyms: (5Z)- 5- {[2,5- dimethyl- 1- (4- methylphenyl)- 1H- pyrrol- 3- yl]methylidene}- 1- (prop- 2- en- 1- yl)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: C=CCN1C(=NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)C)C)/C1=O)S

STK594682
Synonyms: 3- [2- (4- chlorophenyl)- 2- oxoethoxy]- 1- hydroxy- 5- methyl- 9H- xanthen- 9- one
Smiles: Clc1ccc(cc1)C(=O)COc1cc(O)c2c(c1)oc1c(c2=O)cccc1C

STK594683
Synonyms: N- (biphenyl- 2- yl)- 2- {[4- (4- chlorophenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2c2ccccc2)nnc1c1cccc(c1)C

STK594684
Synonyms: 3- ethyl- 9- (4- fluorophenyl)- 1,7- dimethyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: CCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1ccc(cc1)F

STK594685
Synonyms: 2- (4- ethylphenyl)- 7- (4- fluorophenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CCc1ccc(cc1)c1nn2c(n1)c1cnn(c1nc2)c1ccc(cc1)F

STK594686
Synonyms: (6E)- 6- [2- (4- methylphenyl)hydrazinylidene]- 6- (quinolin- 2- yl)hexanoicacid
Smiles: OC(=O)CCCC/C(=N\Nc1ccc(cc1)C)/c1ccc2c(n1)cccc2

STK594689
Synonyms: 3- (3- tert- butyl- 5- methyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)- N- (pyridin- 4- ylmethyl)propanamide
Smiles: O=C(NCc1ccncc1)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C(C)(C)C

STK594690
Synonyms: (4E)- 5- (3,4- dimethoxyphenyl)- 1- (2- hydroxyethyl)- 4- [hydroxy(4- methylphenyl)methylidene]pyrrolidine- 2,3- dione
Smiles: OCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccc(c(c1)OC)OC

STK594691
Synonyms: N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (tetrahydrofuran- 2- ylmethyl)acetamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)C)CC1CCCO1

STK594692
Synonyms: (2Z)- 7- (morpholin- 4- ium- 4- ylmethyl)- 2- (3- nitrobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: O=C1/C(=C/c2cccc(c2)[N+](=O)[O-])/Oc2c1ccc(c2C[NH+]1CCOCC1)[O-]

STK594693
Synonyms: (2'S,3R,7a'S)- 7- chloro- N- (4- methoxyphenyl)- 5- methyl- 2- oxo- 1,1',2,2',5',6',7',7a'- octahydrospiro[indole- 3,3'- pyrrolizine]- 2'- carboxamide
Smiles: COc1ccc(cc1)NC(=O)[C@H]1C[C@H]2N([C@@]31C(=O)Nc1c3cc(C)cc1Cl)CCC2

STK594694
Synonyms: 2- [(6- methyl- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- yl)oxy]- N- (pyridin- 4- ylmethyl)acetamide
Smiles: O=C(NCc1ccncc1)COc1ccc2c(c1C)oc(=O)c1c2CCC1

STK594695
Synonyms: 6- methyl- 5- (3- methylbutyl)- 2- [(4- methylphenyl)amino]pyrimidin- 4- ol
Smiles: CC(CCc1c(C)nc(nc1O)Nc1ccc(cc1)C)C

STK594697
Synonyms: methylN- [(4- benzylpiperazin- 1- yl)carbonyl]- L- phenylalaninate
Smiles: COC(=O)[C@@H](NC(=O)N1CCN(CC1)Cc1ccccc1)Cc1ccccc1

STK594699
Synonyms: (E)- N- {[8- (3- chlorophenyl)- 11- (4- methoxyphenyl)- 10- methyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}- 1- phenylmethanimine
Smiles: COc1ccc(cc1)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)CO/N=C/c1ccccc1)c1cccc(c1)Cl

STK594701
Synonyms: 2- (3- nitrophenyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: [O-][N+](=O)c1cccc(c1)c1nn2c(n1)c1c(nc2)sc2c1CCCC2

STK594702
Synonyms: 5- (2- bromophenyl)- 4- {[(E)- (2,4,5- trimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(OC)c(cc1/C=N/n1c(=S)[nH]nc1c1ccccc1Br)OC

STK594704
Synonyms: (1'S,3R,3'S,7a'S)- 5''- fluoro- 1'- (thiophen- 2- ylcarbonyl)- 5',6',7',7a'- tetrahydro- 1'H- dispiro[indole- 3,2'- pyrrolizine- 3',3''- indole]- 2,2''(1H,1''H)- dione
Smiles: Fc1ccc2c(c1)[C@]1(C(=O)N2)N2CCC[C@H]2[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccs1

STK594705
Synonyms: 10- methyl- 5- (propylsulfanyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CCCSc1nc2sc3c(c2c2n1ncn2)CC(CC3)C

STK594707
Synonyms: 6'- hydroxy- 2,4- dimethyl- 3'- (4- methylphenyl)- 8- nitro- 1,2,4,4a- tetrahydro- 2'H,6H- spiro[1,4- oxazino[4,3- a]quinoline- 5,5'- pyrimidine]- 2',4'(3'H)- dione
Smiles: CC1OC(C)C2N(C1)c1ccc(cc1CC12C(=NC(=O)N(C1=O)c1ccc(cc1)C)O)[N+](=O)[O-]

STK594709
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(4- methylphenyl)carbonyl]- 2'- (phenylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Cc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1)C(=O)Nc1c2cccc1)cccc3

STK594711
Synonyms: (Z)- N- {[8- (4- chlorophenyl)- 10- methyl- 11- phenyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}- 1- (4- methoxyphenyl)methanimine
Smiles: COc1ccc(cc1)/C=N\OCc1nn2c(n1)c1c(nc2)Oc2c(C1c1ccccc1)c(C)nn2c1ccc(cc1)Cl

STK594712
Synonyms: 4- {[(E)- (3- bromo- 4- methoxyphenyl)methylidene]amino}- 5- (2- methylphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1Br)/C=N/n1c(=S)[nH]nc1c1ccccc1C

STK594713
Synonyms: 16- (2- chlorophenyl)- 3,3- dimethyl- 2,3,4,6,7,11,12,16- octahydro- 1H,10H- [1,4]dioxepino[2',3':6,7]isoquino[2,1- a]quinolin- 1- one
Smiles: O=C1CC(C)(C)CC2=C1C(C=C1N2CCc2c1cc1c(c2)OCCCO1)c1ccccc1Cl

STK594714
Synonyms: methylN- {[2- (4- fluorophenyl)ethyl]carbamoyl}- D- phenylalaninate
Smiles: COC(=O)[C@@H](Cc1ccccc1)NC(=O)NCCc1ccc(cc1)F

STK594716
Synonyms: N- [4- (acetylamino)phenyl]- 2- {[3- cyano- 4- (4- ethoxyphenyl)- 5- hydroxy- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)C1C(=C(SCC(=O)Nc2ccc(cc2)NC(=O)C)N=C2C1=C(O)CCC2)C#N

STK594717
Synonyms: 4- (2- methylpropyl)- N- (tetrahydrofuran- 2- ylmethyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 7- amine
Smiles: CC(Cc1nc2oc3c(c2c2c1CCC2)ncnc3NCC1CCCO1)C

STK594718
Synonyms: (E)- (4- fluorophenyl){2- [4- (methoxycarbonyl)phenyl]- 1- [3- (morpholin- 4- ium- 4- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}methanolate
Smiles: COC(=O)c1ccc(cc1)C1/C(=C(/c2ccc(cc2)F)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1

STK594719
Synonyms: N- (4- butylphenyl)- 2- ({5- [(4- chlorophenoxy)methyl]- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OC)COc1ccc(cc1)Cl

STK594720
Synonyms: (5E)- 5- ({[1- (1H- indol- 3- yl)butan- 2- yl]amino}methylidene)- 1- (prop- 2- en- 1- yl)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: C=CCN1C(=NC(=O)/C(=C\NC(Cc2c[nH]c3c2cccc3)CC)/C1=O)S

STK594721
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3,5- dimethoxyphenyl)acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2Cc2ccco2)COc2ccc(cc2)Cl)cc(c1)OC

STK594722
Synonyms: methyl3,3,3'- tris(2- methylphenyl)- 3H,3'H- spiro[2- benzothiophene- 1,2'- [1,3,4]thiadiazole]- 5'- carboxylate
Smiles: COC(=O)C1=NN(C2(S1)SC(c1c2cccc1)(c1ccccc1C)c1ccccc1C)c1ccccc1C

STK594723
Synonyms: (5Z)- 5- [1- acetyl- 5- (2,4- dimethoxyphenyl)pyrazolidin- 3- ylidene]- 1- (4- chlorophenyl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(c(c1)OC)C1C/C(=C/2\C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)/NN1C(=O)C

STK594724
Synonyms: N- [3- (dimethylamino)propyl]- 5- methyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CN(CCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCC2)C

STK594725
Synonyms: N- [4- (butan- 2- yl)phenyl]- 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl)C

STK594726
Synonyms: methylN- [(2- chlorophenyl)carbamoyl]- D- leucinate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccccc1Cl)CC(C)C

STK594728
Synonyms: 4- imino- 9,10- dimethoxy- 2- [4- (methylsulfanyl)phenyl]- 6,7- dihydro- 4H- pyrido[2,1- a]isoquinoline- 3- carbonitrile
Smiles: N#Cc1c(cc2n(c1=N)CCc1c2cc(OC)c(c1)OC)c1ccc(cc1)SC

STK594729
Synonyms: 2- methoxy- N- [1- methyl- 4- oxo- 3- (3,4,5- trimethoxyphenyl)- 1,4- dihydroquinolin- 2- yl]benzamide
Smiles: COc1cc(cc(c1OC)OC)c1c(NC(=O)c2ccccc2OC)n(C)c2c(c1=O)cccc2

STK594732
Synonyms: N- (3- methylphenyl)- 2- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)acetamide
Smiles: O=C(Nc1cccc(c1)C)CN1CCc2c(C1)cc1c(c2)OCCCO1

STK594734
Synonyms: 8- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 7- [2- (morpholin- 4- yl)ethyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1CCN1CCOCC1)c(=O)n(c(=O)n2C)C

STK594735
Synonyms: N- [(E)- (2- fluorophenyl)methylidene]- 1H- benzimidazol- 1- amine
Smiles: Fc1ccccc1/C=N/n1cnc2c1cccc2

STK594736
Synonyms: (1'R,2'R)- 2'- (3- chlorophenyl)- 1'- [(4- chlorophenyl)carbonyl]- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: Clc1cccc(c1)[C@H]1[C@H](C(=O)c2ccc(cc2)Cl)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1

STK594737
Synonyms: 3- (3- chlorophenyl)- 1- [3- (dimethylamino)propyl]- 7- methyl- 5,6,7,8- tetrahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidine- 2,4(1H,3H)- dione
Smiles: CN(CCCn1c2sc3c(c2c(=O)n(c1=O)c1cccc(c1)Cl)CCN(C3)C)C

STK594738
Synonyms: 2- (1,3- benzothiazol- 2- yl)- 1- (2,3- dimethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1c(OC)cccc1C1N(c2nc3c(s2)cccc3)C(=O)c2c1c(=O)c1c(o2)cccc1

STK594739
Synonyms: N- [4- (butan- 2- yl)phenyl]- 2- {[5- (2- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1Cc1ccco1)c1ccccc1Cl)C

STK594742
Synonyms: methyl2- {[(6,8- dimethyl- 4- oxo- 4H- chromen- 2- yl)carbonyl]amino}- 5,6- dihydro- 4H- cyclopenta[b]thiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)c(C)cc(c3)C)sc2c1CCC2

STK594743
Synonyms: 3- [(2,6- dichlorobenzyl)sulfanyl]- 5- (4- fluorophenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazole
Smiles: C=CCn1c(SCc2c(Cl)cccc2Cl)nnc1c1ccc(cc1)F

STK594744
Synonyms: 4- {[(2'S,3S,3'S,10b'R)- 2- oxo- 2'- {[4- (prop- 2- en- 1- yloxy)phenyl]carbonyl}- 1,2,2',3'- tetrahydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 3'- yl]carbonyl}phenylacetate
Smiles: C=CCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)OC(=O)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK594745
Synonyms: (4E)- 2- (2,4- dimethoxyphenyl)- 4- {[(3- methoxyphenyl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc(c(c1)OC)N1C(=O)/C(=C/Nc2cccc(c2)OC)/c2c(C1=O)cccc2

STK594746
Synonyms: (4E)- 5- (3- butoxyphenyl)- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 1- (1,3- thiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: CCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1nccs1

STK594747
Synonyms: methylN- [(4- methylphenyl)carbamoyl]- D- alaninate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccc(cc1)C)C

STK594749
Synonyms: 5- [3- (benzyloxy)phenyl]- N'- [(E)- (4- ethylphenyl)methylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: CCc1ccc(cc1)/C=N/NC(=O)c1n[nH]c(c1)c1cccc(c1)OCc1ccccc1

STK594751
Synonyms: (4E)- 5- (4- ethylphenyl)- 4- [hydroxy(thiophen- 2- yl)methylidene]- 1- [5- (methylsulfanyl)- 1,3,4- thiadiazol- 2- yl]pyrrolidine- 2,3- dione
Smiles: CCc1ccc(cc1)C1/C(=C(/c2cccs2)\O)/C(=O)C(=O)N1c1nnc(s1)SC

STK594752
Synonyms: 3- methoxy- N- [1- methyl- 3- (naphthalen- 1- yl)- 4- oxo- 1,4- dihydroquinolin- 2- yl]benzamide
Smiles: COc1cccc(c1)C(=O)Nc1n(C)c2ccccc2c(=O)c1c1cccc2c1cccc2

STK594754
Synonyms: 8,8- dimethyl- 5- [(4- methylphenyl)amino]- 3- {[2- (3- nitrophenyl)- 2- oxoethyl]sulfanyl}- 7,10- dihydro- 8H- pyrano[3,4- c][1,2,4]triazolo[4,3- a]pyridine- 6- carbonitrile
Smiles: N#Cc1c2CC(C)(C)OCc2c2n(c1Nc1ccc(cc1)C)c(SCC(=O)c1cccc(c1)[N+](=O)[O-])nn2

STK594755
Synonyms: 4- {[(E)- (4- chloro- 3- nitrophenyl)methylidene]amino}- 5- (furan- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: [O-][N+](=O)c1cc(ccc1Cl)/C=N/n1c(=S)[nH]nc1c1ccco1

STK594756
Synonyms: 7- bromo- 2- (6- methylpyridin- 2- yl)- 1- (3- nitrophenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1cccc(n1)N1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)ccc(c1)Br

STK594757
Synonyms: N- (3- nitrophenyl)- 2- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)acetamide
Smiles: O=C(Nc1cccc(c1)[N+](=O)[O-])CN1CCc2c(C1)cc1c(c2)OCCCO1

STK594758
Synonyms: 5- (3- chlorophenyl)- 4- {[(E)- (2,3- dimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1c(cccc1OC)/C=N/n1c(=S)[nH]nc1c1cccc(c1)Cl

STK594759
Synonyms: 5- {[2,5- dimethyl- 1- (4- methylphenyl)- 1H- pyrrol- 3- yl]methylidene}- 1,3- dimethylpyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: Cc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)N(C)C(=O)N(C1=O)C

STK594760
Synonyms: methylN- [(2- phenylethyl)carbamoyl]- L- leucinate
Smiles: COC(=O)[C@@H](NC(=O)NCCc1ccccc1)CC(C)C

STK594761
Synonyms: (4E)- 2- (3- methoxyphenyl)- 4- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1cccc(c1)N1C(=O)/C(=C/NCCCN2CCOCC2)/c2c(C1=O)cccc2

STK594763
Synonyms: 1- tert- butyl4- (4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- yl)piperidine- 1,4- dicarboxylate
Smiles: O=C(C1CCN(CC1)C(=O)OC(C)(C)C)Oc1ccc2c(c1)oc(=O)c1c2CCC1

STK594765
Synonyms: 3- (2- chlorophenyl)- 5- (2- ethyl- 2,3,4,9- tetrahydro- 1H- beta- carbolin- 1- yl)- 2,6- dihydroxypyrimidin- 4(3H)- one
Smiles: CCN1CCc2c(C1c1c(O)nc(n(c1=O)c1ccccc1Cl)O)[nH]c1c2cccc1

STK594766
Synonyms: (3S,3a'R,8a'S,8b'S)- 2'- (3- chloro- 2- methylphenyl)- 5- ethyl- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: CCc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1C)Cl

STK594768
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(2,5- dimethoxyphenyl)carbonyl]- 2'- [(4- propoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: CCCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2cc(OC)ccc2OC)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK594770
Synonyms: (5Z)- 5- {1- [(2,4- dimethoxyphenyl)amino]ethylidene}- 6- hydroxy- 3- (4- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1cc(OC)ccc1N/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)C)O)/C

STK594771
Synonyms: (4E)- 5- (2,4- dimethoxyphenyl)- 4- [hydroxy(4- methoxyphenyl)methylidene]- 1- (4- methoxyphenyl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)/C(=C\1/C(c2ccc(cc2OC)OC)N(C(=O)C1=O)c1ccc(cc1)OC)/O

STK594772
Synonyms: N- [2- ({(1E)- 1- [4- hydroxy- 2,6- dioxo- 1- (prop- 2- en- 1- yl)- 1,6- dihydropyrimidin- 5(2H)- ylidene]propyl}amino)phenyl]propanamide
Smiles: C=CCN1C(=O)N=C(/C(=C(\Nc2ccccc2NC(=O)CC)/CC)/C1=O)O

STK594774
Synonyms: 1- (6- hydroxy- 3- methyl- 2- oxo- 7- {2- [(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]ethyl}- 3,7- dihydro- 2H- purin- 8- yl)piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)c1nc2c(n1CCSc1nnnn1c1ccccc1)c(O)nc(=O)n2C

STK594775
Synonyms: N- (3- chloro- 4- fluorophenyl)- 2- {[5- (4- methoxyphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)Nc1ccc(c(c1)Cl)F

STK594776
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 2- [(2- ethyl[1]benzofuro[3,2- d]pyrimidin- 4- yl)sulfanyl]acetamide
Smiles: CCc1nc(SCC(=O)Nc2ccc(c(c2)Cl)OC)c2c(n1)c1ccccc1o2

STK594777
Synonyms: 1- (2- {[(3- hydroxyquinoxalin- 2- yl)(phenyl)methyl]sulfanyl}- 1H- benzimidazol- 1- yl)ethanone
Smiles: Oc1nc2ccccc2nc1C(c1ccccc1)Sc1nc2c(n1C(=O)C)cccc2

STK594778
Synonyms: 2- {[4- phenyl- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [2- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1nnc(n1c1ccccc1)c1ccccn1

STK594779
Synonyms: (4E)- 1- (5- acetyl- 4- methyl- 1,3- thiazol- 2- yl)- 5- [3- (benzyloxy)phenyl]- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]pyrrolidine- 2,3- dione
Smiles: O/C(=C/1\C(c2cccc(c2)OCc2ccccc2)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)C)/c1ccc2c(c1)OCCO2

STK594782
Synonyms: (2'S,3S,3'S,10b'R)- 2'- {[4- (2- methylpropyl)phenyl]carbonyl}- 3'- [(3- nitrophenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: CC(Cc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2cccc(c2)[N+](=O)[O-])N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C

STK594784
Synonyms: (4E)- 5- (4- chlorophenyl)- 4- [hydroxy(5- methylfuran- 2- yl)methylidene]- 1- [5- (methylsulfanyl)- 1,3,4- thiadiazol- 2- yl]pyrrolidine- 2,3- dione
Smiles: CSc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2ccc(o2)C)/O)/C1c1ccc(cc1)Cl

STK594785
Synonyms: N- (3- fluorophenyl)- 2- {[4- (4- methylphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)F)nnc1COc1ccccc1

STK594786
Synonyms: 2- {[5- (2- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [4- chloro- 2- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1C(F)(F)F)Cl)CSc1nnc(n1Cc1ccco1)c1ccccc1Cl

STK594787
Synonyms: N- [(1S)- 3- (methylsulfanyl)- 1- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)propyl]- 1,3- benzodioxole- 5- carboxamide
Smiles: CSCC[C@@H](c1nnc2n1cccc2)NC(=O)c1ccc2c(c1)OCO2

STK594788
Synonyms: 2- ({4- (4- chlorophenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccc(cc1)C

STK594790
Synonyms: N- [7- (4- fluorophenyl)- 5- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]- 4- methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)Nc1[nH]c2=NC(=CC(n2n1)c1ccc(cc1)F)c1ccccc1

STK594791
Synonyms: 4- bromo- N'- {(E)- [4- methoxy- 3- (morpholin- 4- ylmethyl)phenyl]methylidene}benzohydrazide
Smiles: COc1ccc(cc1CN1CCOCC1)/C=N/NC(=O)c1ccc(cc1)Br

STK594793
Synonyms: 10- methyl- 2- [(naphthalen- 1- yloxy)methyl]- 8- phenyl- 11- (pyridin- 3- yl)- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1nn(c2c1C(c1cccnc1)c1c(O2)ncn2c1nc(n2)COc1cccc2c1cccc2)c1ccccc1

STK594794
Synonyms: N- {2- [(3E)- 3- [(4- chlorophenyl)(hydroxy)methylidene]- 2- (3- nitrophenyl)- 4,5- dioxopyrrolidin- 1- yl]ethyl}acetamide
Smiles: CC(=O)NCCN1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=O

STK594796
Synonyms: (E)- {1- [4- (dimethylammonio)phenyl]- 4,5- dioxo- 2- phenylpyrrolidin- 3- ylidene}(phenyl)methanolate
Smiles: [O-]/C(=C\1/C(=O)C(=O)N(C1c1ccccc1)c1ccc(cc1)[NH+](C)C)/c1ccccc1

STK594798
Synonyms: 6- (4- chlorobenzyl)- 9- fluoro- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 5(6H)- one
Smiles: Clc1ccc(cc1)Cn1c2ccc(cc2c2c1c(=O)n1c(n2)SCC1)F

STK594799
Synonyms: N- (3- chloro- 2- methylphenyl)- 2- {[4- (4- chlorophenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1C)Cl)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK594801
Synonyms: methylN- {[2- (trifluoromethyl)phenyl]carbamoyl}- L- alaninate
Smiles: COC(=O)[C@@H](NC(=O)Nc1ccccc1C(F)(F)F)C

STK594802
Synonyms: 4- (4- ethoxyphenyl)- 3,4,5,6- tetrahydrobenzo[h]quinazolin- 2- ol
Smiles: CCOc1ccc(cc1)C1NC(=NC2=C1CCc1c2cccc1)O

STK594803
Synonyms: 4- hydroxy- 1,7- dimethyl- 9- propyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purin- 2(1H)- one
Smiles: CCCN1CC(C)Cn2c1nc1c2c(O)nc(=O)n1C

STK594804
Synonyms: N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- phenylbenzenesulfonamide
Smiles: O=c1[nH]c2ccccc2cc1CN(S(=O)(=O)c1ccccc1)c1ccccc1

STK594805
Synonyms: N- (2,4- difluorophenyl)- 2- {[4- phenyl- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1F)F)CSc1nnc(n1c1ccccc1)c1ccccn1

STK594808
Synonyms: (3S,3a'R,8a'S,8b'S)- 2'- [2- chloro- 5- (trifluoromethyl)phenyl]- 5- ethyl- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: CCc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1Cl)C(F)(F)F

STK594809
Synonyms: 8- [(4- benzylpiperidin- 1- yl)methyl]- 1,3- dimethyl- 7- (2- oxo- 2- phenylethyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=C(c1ccccc1)Cn1c(CN2CCC(CC2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK594811
Synonyms: methylN- [(2,3- dimethylphenyl)carbamoyl]- D- alaninate
Smiles: COC(=O)[C@H](NC(=O)Nc1cccc(c1C)C)C

STK594813
Synonyms: N- (2- chloro- 6- fluorobenzyl)- 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]hexanamide
Smiles: O=C(NCc1c(F)cccc1Cl)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK594814
Synonyms: N'- [(E)- (3- hydroxyphenyl)methylidene]- 5- (2- methoxynaphthalen- 1- yl)- 1H- pyrazole- 3- carbohydrazide
Smiles: COc1ccc2c(c1c1[nH]nc(c1)C(=O)N/N=C/c1cccc(c1)O)cccc2

STK594817
Synonyms: 2- fluoro- N- (furan- 2- ylmethyl)- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: Fc1ccccc1C(=O)N(Cc1cc2ccccc2[nH]c1=O)Cc1ccco1

STK594818
Synonyms: 3- (2- fluorophenyl)- 4- phenyl- 5- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 4H- 1,2,4- triazole
Smiles: Fc1ccccc1c1nnc(n1c1ccccc1)SC/C=C/c1ccccc1

STK594820
Synonyms: N- (2- fluorophenyl)- 2- {[4- (4- methoxyphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2F)nnc1c1ccccn1

STK594822
Synonyms: 8- (4- ethylpiperazin- 1- yl)- 6- hydroxy- 3- methyl- 7- (2- phenylethyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCN1CCN(CC1)c1nc2c(n1CCc1ccccc1)c(O)nc(=O)n2C

STK594823
Synonyms: 4- (5- chloro- 2- methoxyphenyl)- 5- (pyridin- 3- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1n1c(=S)[nH]nc1c1cccnc1)Cl

STK594824
Synonyms: 8- [(2,6- dimethylmorpholin- 4- yl)methyl]- 6- hydroxy- 3- methyl- 7- (2- phenylethyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC1CN(CC(O1)C)Cc1nc2c(n1CCc1ccccc1)c(O)nc(=O)n2C

STK594825
Synonyms: 4- [4- (benzyloxy)phenoxy][1,2,4]triazolo[4,3- a]quinoxaline
Smiles: c1ccc(cc1)COc1ccc(cc1)Oc1nc2ccccc2n2c1nnc2

STK594826
Synonyms: N- (4- chlorophenyl)- 1- (4- ethylphenyl)- 4- (4- methoxyphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCc1ccc(cc1)c1c(C(=O)Nc2ccc(cc2)Cl)n2c3c1CCCCn3c(c2)c1ccc(cc1)OC

STK594828
Synonyms: methylN- (benzylcarbamoyl)- D- alaninate
Smiles: COC(=O)[C@H](NC(=O)NCc1ccccc1)C

STK594830
Synonyms: 8- (4- benzylpiperazin- 1- yl)- 6- hydroxy- 3- methyl- 7- {2- [(4- methylpyrimidin- 2- yl)sulfanyl]ethyl}- 3,7- dihydro- 2H- purin- 2- one
Smiles: Cc1ccnc(n1)SCCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccccc1

STK594831
Synonyms: (2Z)- 2- (4- hydroxy- 2- oxo- 1,3- thiazol- 5(2H)- ylidene)- N- (4- hydroxyphenyl)ethanamide
Smiles: O=C(Nc1ccc(cc1)O)/C=C/1\SC(=O)N=C1O

STK594832
Synonyms: 2- (furan- 2- yl)- 8- methoxy- 3- (4- methoxybenzyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COc1ccc(cc1)Cn1c(nc2c(c1=O)c(=O)c1c(o2)cc(cc1)OC)c1ccco1

STK594834
Synonyms: 4- {[(E)- anthracen- 9- ylmethylidene]amino}- 5- (3- chlorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1c2ccccc2cc2c1cccc2

STK594835
Synonyms: 7'- {(E)- [1- (2,5- dimethylphenyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}- 1,3- dimethyl- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- t
Smiles: Cc1ccc(c(c1)N1C(=O)N=C(/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O)C

STK594836
Synonyms: N- [3- (4- methylphenyl)- 4- oxo- 4H- thiochromen- 2- yl]- 2- (thiophen- 2- yl)acetamide
Smiles: O=C(Nc1sc2ccccc2c(=O)c1c1ccc(cc1)C)Cc1cccs1

STK594837
Synonyms: 7- (2,6- dichlorobenzyl)- 1,3- dimethyl- 8- [(4- methylpiperidin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC1CCN(CC1)Cc1nc2c(n1Cc1c(Cl)cccc1Cl)c(=O)n(c(=O)n2C)C

STK594838
Synonyms: methyl4- [({[4- (4- chlorophenyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)amino]benzoate
Smiles: COc1cccc(c1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(cc1)C(=O)OC

STK594840
Synonyms: 2- cyclohexyl- 3- (4- methylphenyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: Cc1ccc(cc1)n1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)C1CCCCC1

STK594843
Synonyms: methyl(5- methyl- 4- oxo- 4,5- dihydro- 3H- pyrimido[5,4- b]indol- 3- yl)acetate
Smiles: COC(=O)Cn1cnc2c(c1=O)n(C)c1c2cccc1

STK594844
Synonyms: 3- [(Z)- (3- butyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 2- [4- (2- fluorophenyl)piperazin- 1- yl]- 7- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2F)/C1=O

STK594846
Synonyms: 8- chloro- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- ylN- (tert- butoxycarbonyl)- D- methioninate
Smiles: CSCC[C@H](C(=O)Oc1cc2oc(=O)c3c(c2cc1Cl)CCC3)NC(=O)OC(C)(C)C

STK594848
Synonyms: 2- [(3a'S,6a'R)- 5- chloro- 5'- (2- methoxyethyl)- 2,4',6'- trioxo- 1,2,3',3a',4',5',6',6a'- octahydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 3'- yl]acetamide
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1cc(Cl)cc2

STK594849
Synonyms: 13- (4- bromophenyl)- 9,10- dimethoxy- 3,3- dimethyl- 2,3,4,6,7,13- hexahydro- 1H- isoquino[2,1- a]quinolin- 1- one
Smiles: COc1cc2c(cc1OC)CCN1C2=CC(c2ccc(cc2)Br)C2=C1CC(CC2=O)(C)C

STK594850
Synonyms: (4E)- 4- [hydroxy(phenyl)methylidene]- 1- (3- nitrophenyl)- 5- (4- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: O=C1C(=O)/C(=C(\c2ccccc2)/O)/C(N1c1cccc(c1)[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-]

STK594851
Synonyms: 2- [(7,7- dimethyl- 2- phenyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl)sulfanyl]- 1- (piperidin- 1- yl)ethanone
Smiles: O=C(N1CCCCC1)CSc1nc(nc2c1COC(C2)(C)C)c1ccccc1

STK594852
Synonyms: (2E)- 2- (2,3- dihydro- 1H- indol- 1- ylcarbonyl)- 3- (6- methoxy- 4- oxo- 4H- chromen- 3- yl)prop- 2- enenitrile
Smiles: N#C/C(=C\c1coc2c(c1=O)cc(cc2)OC)/C(=O)N1CCc2c1cccc2

STK594854
Synonyms: N- (4- bromo- 2- methylphenyl)- 2- {[5- (3- chlorophenyl)- 4- (4- chlorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)Br)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK594855
Synonyms: (5E)- 5- {[1- (2- chlorobenzyl)- 2,3- dihydro- 1H- indol- 5- yl]methylidene}- 3- (3- chlorophenyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: Clc1cccc(c1)N1C(=O)N=C(/C(=C\c2ccc3c(c2)CCN3Cc2ccccc2Cl)/C1=O)O

STK594856
Synonyms: (4E)- 5- (4- fluorophenyl)- 4- [hydroxy(4- methoxyphenyl)methylidene]- 1- methylpyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)F)C)/O

STK594857
Synonyms: (6E)- 7- imino- 2- methyl- 6- [4- (propan- 2- yl)benzylidene]- 6,7- dihydro- 5H- [1,2]oxazolo[2,3- a]pyrimidin- 5- one
Smiles: Cc1on2c(=NC(=O)/C(=C/c3ccc(cc3)C(C)C)/C2=N)c1

STK594860
Synonyms: 1- {3- [(4- chlorobenzyl)oxy]phenyl}- 7- methyl- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1cccc(c1)OCc1ccc(cc1)Cl)c(=O)c1c(o2)ccc(c1)C

STK594861
Synonyms: 7- (2- methylphenyl)- 3- (pyridin- 4- yl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: Cc1ccccc1n1ncc2c1ncn1c2nnc1c1ccncc1

STK594863
Synonyms: (3S,3'R,3a'R,6a'S)- 5'- tert- butyl- 3'- [(4- chlorophenyl)(hydroxy)methyl]- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: Clc1ccc(cc1)[C@H]([C@@H]1N[C@]2([C@@H]3[C@H]1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cccc1)O

STK594864
Synonyms: methylN- [(3- hydroxyquinoxalin- 1(2H)- yl)carbonyl]- L- leucinate
Smiles: COC(=O)[C@@H](NC(=O)N1CC(=Nc2c1cccc2)O)CC(C)C

STK594865
Synonyms: 3- (3- chlorobenzyl)- 8- (4- chlorophenyl)- 1- methyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: Clc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1cccc(c1)Cl

STK594866
Synonyms: 2- (2- methoxyphenyl)- 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: COc1ccccc1c1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

STK594867
Synonyms: 16- (1,3- benzodioxol- 5- yl)- 3,3- dimethyl- 2,3,4,6,7,11,12,16- octahydro- 1H,10H- [1,4]dioxepino[2',3':6,7]isoquino[2,1- a]quinolin- 1- one
Smiles: O=C1CC(C)(C)CC2=C1C(C=C1N2CCc2c1cc1c(c2)OCCCO1)c1ccc2c(c1)OCO2

STK594868
Synonyms: 1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl(5- methoxy- 3- methyl- 1H- indol- 2- yl)methanone
Smiles: COc1ccc2c(c1)c(C)c([nH]2)C(=O)N1CCC2(CC1)OCCO2

STK594869
Synonyms: (4E)- 2- (2- fluorophenyl)- 4- {[(2- hydroxyethyl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: OCCN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccccc1F

STK594870
Synonyms: (3R,3'S,3a'S,6a'R)- 5'- [2- chloro- 5- (trifluoromethyl)phenyl]- 3'- [2- (methylsulfanyl)ethyl]- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CSCC[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1cc(ccc1Cl)C(F)(F)F)C(=O)Nc1c2cccc1

STK594871
Synonyms: 4- (10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)- N,N- dimethylaniline
Smiles: CN(c1ccc(cc1)c1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2)C

STK594872
Synonyms: 2- {[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (3,4- dichlorophenyl)ethanone
Smiles: Clc1cccc(c1)c1nnc(n1C)SCC(=O)c1ccc(c(c1)Cl)Cl

STK594874
Synonyms: (4E)- 5- (4- fluorophenyl)- 4- [hydroxy(phenyl)methylidene]- 1- (pyridin- 3- yl)pyrrolidine- 2,3- dione
Smiles: Fc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1cccnc1

STK594875
Synonyms: (3a'S,6a'R)- 5- chloro- 5'- [2- (3,4- dimethoxyphenyl)ethyl]- 3'- methyl- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(NC3C)C(=O)Nc3c2cc(Cl)cc3)ccc1OC

STK594876
Synonyms: 3- [11- (furan- 2- yl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]naphthalen- 2- ol
Smiles: Cc1nn(c2c1C(c1ccco1)c1c(O2)ncn2c1nc(n2)c1cc2ccccc2cc1O)c1ccccc1

STK594877
Synonyms: (4E)- 4- [(4- chlorophenyl)(hydroxy)methylidene]- 5- (2- fluorophenyl)- 1- (4- methylphenyl)pyrrolidine- 2,3- dione
Smiles: Cc1ccc(cc1)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccccc1F

STK594878
Synonyms: 3- [2- (4- fluorophenyl)ethyl]- 5- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Fc1ccc(cc1)CCn1cnc2c(c1=O)n(C)c1c2cccc1

STK594880
Synonyms: methylN- [(4- methoxyphenyl)sulfonyl]- N- phenyl- beta- alaninate
Smiles: COC(=O)CCN(S(=O)(=O)c1ccc(cc1)OC)c1ccccc1

STK594881
Synonyms: 4- chloro- N- [3- (2- chlorophenyl)- 1- ethyl- 4- oxo- 1,4- dihydroquinolin- 2- yl]benzamide
Smiles: CCn1c(NC(=O)c2ccc(cc2)Cl)c(c2ccccc2Cl)c(=O)c2c1cccc2

STK594883
Synonyms: (5E)- 5- ({[3- (dimethylamino)propyl]amino}methylidene)- 6- hydroxy- 3- (4- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: CN(CCCN/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)C)O)C

STK594884
Synonyms: N- [4- (diethylamino)phenyl]- 2- {[4- phenyl- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)c1ccccn1)CC

STK594885
Synonyms: 2- (8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)aniline
Smiles: Nc1ccccc1c1nn2c(n1)c1c(nc2)sc2c1CCCC2

STK594886
Synonyms: methylN- [(4- ethylphenyl)carbamoyl]- D- alaninate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccc(cc1)CC)C

STK594887
Synonyms: 3,4,5- trimethoxy- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (tetrahydrofuran- 2- ylmethyl)benzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)N(Cc1cc2ccc(cc2[nH]c1=O)C)CC1CCCO1

STK594888
Synonyms: 2- (butylsulfanyl)- 5- hydroxy- 4- (4- methoxyphenyl)- 7,7- dimethyl- 4,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: CCCCSC1=C(C#N)C(C2=C(CC(CC2=N1)(C)C)O)c1ccc(cc1)OC

STK594889
Synonyms: ethyl(3- {(Z)- [1- (4- bromobenzyl)- 2- hydroxy- 5- oxo- 1,5- dihydro- 4H- imidazol- 4- ylidene]methyl}- 1H- indol- 1- yl)acetate
Smiles: CCOC(=O)Cn1cc(c2c1cccc2)/C=C/1\N=C(N(C1=O)Cc1ccc(cc1)Br)O

STK594890
Synonyms: 6- chloro- 2- oxo- 4- propyl- 2H- chromen- 7- yl6- {[(benzyloxy)carbonyl]amino}hexanoate
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)CCCCCNC(=O)OCc1ccccc1

STK594891
Synonyms: 2- {[6- cyano- 8,8- dimethyl- 5- (phenylamino)- 7,10- dihydro- 8H- pyrano[3,4- c][1,2,4]triazolo[4,3- a]pyridin- 3- yl]sulfanyl}- N- (4- methoxyphenyl)acetamide
Smiles: N#Cc1c(Nc2ccccc2)n2c(SCC(=O)Nc3ccc(cc3)OC)nnc2c2c1CC(C)(C)OC2

STK594894
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)F)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)C

STK594895
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,4- dichlorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)C

STK594896
Synonyms: N- [3- (morpholin- 4- yl)propyl]- N- (naphthalen- 1- ylmethyl)- 5- phenylthieno[2,3- d]pyrimidin- 4- amine
Smiles: O1CCN(CC1)CCCN(c1ncnc2c1c(cs2)c1ccccc1)Cc1cccc2c1cccc2

STK594898
Synonyms: (5E)- 5- [(1- benzyl- 1,2,3,4- tetrahydroquinolin- 6- yl)methylidene]- 3- (4- fluorophenyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: Fc1ccc(cc1)N1C(=O)N=C(/C(=C\c2ccc3c(c2)CCCN3Cc2ccccc2)/C1=O)O

STK594899
Synonyms: ([(4- fluorophenyl)amino]{[2- (3- methoxyphenyl)- 2- oxoethyl]sulfanyl}methylidene)propanedinitrile
Smiles: COc1cccc(c1)C(=O)CSC(=C(C#N)C#N)Nc1ccc(cc1)F

STK594900
Synonyms: 2- bromo- N'- {4- [(5Z)- 5- (4- methylbenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}benzohydrazide
Smiles: O=C(NNC(=O)c1ccccc1Br)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK594901
Synonyms: N- (4- butylphenyl)- 2- {[5- (4- methoxyphenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)CCCC)nnc1c1ccc(cc1)OC

STK594902
Synonyms: 2- (6- methoxy- 1,3- benzothiazol- 2- yl)- 1- (4- propoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCCOc1ccc(cc1)C1N(c2sc3c(n2)ccc(c3)OC)C(=O)c2c1c(=O)c1c(o2)cccc1

STK594903
Synonyms: N- (2,3- dimethylphenyl)- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzenesulfonamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(S(=O)(=O)c1ccccc1)c1cccc(c1C)C

STK594904
Synonyms: 1- (1,3- dimethyl- 2,4,6- trioxo- 1,1',2',3,3',3a',4,6- octahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinolin]- 7'- yl)- 3- prop- 2- en- 1- ylthiourea
Smiles: C=CCNC(=S)Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C

STK594905
Synonyms: methyl4- [({[5- (4- methoxyphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)amino]benzoate
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)Nc1ccc(cc1)C(=O)OC

STK594906
Synonyms: (2Z)- 1- (2,4- dinitrophenyl)- 2- [4- methyl- 2- (2- methylpentan- 2- yl)cyclohexylidene]hydrazine
Smiles: CCCC(C1CC(C)CC/C/1=N/Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])(C)C

STK594907
Synonyms: 2- (phenylcarbonyl)- 6- oxaspiro[2.5]octane- 1,1- dicarbonitrile
Smiles: N#CC1(C#N)C(C21CCOCC2)C(=O)c1ccccc1

STK594908
Synonyms: N- (2- chloro- 4,6- dimethylphenyl)- 2- {[5- (3- methylphenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2c(C)cc(cc2Cl)C)nnc1c1cccc(c1)C

STK594909
Synonyms: methylN- [(4,5,6- trimethoxy- 1H- indol- 2- yl)carbonyl]glycinate
Smiles: COC(=O)CNC(=O)c1cc2c([nH]1)cc(c(c2OC)OC)OC

STK594910
Synonyms: N- [4- (butan- 2- yl)phenyl]- 2- {[4- (4- ethoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(CC)C)nnc1COc1ccccc1

STK594911
Synonyms: (3E)- 3- (3,4- dimethoxybenzylidene)- 4- imino- 3,4- dihydro- 2H- pyrimido[2,1- b][1,3]benzothiazol- 2- one
Smiles: COc1cc(ccc1OC)/C=C\1/C(=O)N=c2n(C1=N)c1ccccc1s2

STK594912
Synonyms: 2- {[4- (4- methoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (naphthalen- 2- yl)ethanone
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc3c(c2)cccc3)nnc1c1cccc(c1)C

STK594913
Synonyms: 4- (4- chlorophenyl)- 1- (4- ethoxyphenyl)- N- (2- methoxyphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCOc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1OC)cc3c1ccc(cc1)Cl

STK594914
Synonyms: 4- chloro- N- [7- (4- chlorophenyl)- 5- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]benzenesulfonamide
Smiles: Clc1ccc(cc1)C1C=C(N=c2n1nc([nH]2)NS(=O)(=O)c1ccc(cc1)Cl)c1ccccc1

STK594915
Synonyms: (E)- 2,3- dihydro- 1,4- benzodioxin- 6- yl{1- [2- (dimethylammonio)ethyl]- 2- [3- ethoxy- 4- (pentyloxy)phenyl]- 4,5- dioxopyrrolidin- 3- ylidene}methanolate
Smiles: CCCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CC[NH+](C)C

STK594916
Synonyms: (5E)- 5- (3,5- dibromo- 2- hydroxybenzylidene)- 4- hydroxy- 1,3- thiazole- 2(5H)- thione
Smiles: S=C1S/C(=C/c2cc(Br)cc(c2O)Br)/C(=N1)O

STK594918
Synonyms: N'- [(E)- (2,5- dimethoxyphenyl)methylidene]- 4- methoxy- 1H- indole- 2- carbohydrazide
Smiles: COc1ccc(c(c1)/C=N/NC(=O)c1cc2c([nH]1)cccc2OC)OC

STK594921
Synonyms: N- [3- (2- fluorophenyl)- 1- methyl- 4- oxo- 1,4- dihydroquinolin- 2- yl]- 4- methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1n(C)c2ccccc2c(=O)c1c1ccccc1F

STK594923
Synonyms: N- [(3- methylphenyl)carbamoyl]- L- alanine
Smiles: O=C(N[C@H](C(=O)O)C)Nc1cccc(c1)C

STK594924
Synonyms: N- [2- chloro- 5- (trifluoromethyl)phenyl]- 6- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)hexanamide
Smiles: O=C(Nc1cc(ccc1Cl)C(F)(F)F)CCCCCn1nnc2c(c1=O)cccc2