COMPOUNDS FOR BIOLOGICAL SCREENING
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STK587722
Synonyms: 3- [(3a'S,6a'R)- 5'- (2- chlorobenzyl)- 5- fluoro- 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]propanoicacid
Smiles: OC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cc(F)cc1

STK587723
Synonyms: 2- [(4- ethyl- 8- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- [3- (1H- imidazol- 1- yl)propyl]propanamide
Smiles: CCc1cc(=O)oc2c1ccc(c2C)OC(C(=O)NCCCn1cncc1)C

STK587724
Synonyms: 2- ({4- amino- 5- [5- (4- chlorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- butylphenyl)acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK587725
Synonyms: 2,2- dimethyl- 5- (2- methylpropyl)- N- (pyridin- 3- ylmethyl)- 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)ncnc3NCc1cccnc1)C

STK587727
Synonyms: 12- (4- ethylphenyl)- 2,3,4,12- tetrahydrobenzimidazo[2,1- b]quinazolin- 1- ol
Smiles: CCc1ccc(cc1)C1C2=C(O)CCCC2=Nc2n1c1ccccc1n2

STK587730
Synonyms: (5E)- 5- (1- {[4- (dimethylamino)phenyl]amino}ethylidene)- 6- hydroxy- 3- (2- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C(\Nc2ccc(cc2)N(C)C)/C)/C(=O)N1c1ccccc1C

STK587731
Synonyms: 8- (4- methoxyphenyl)- 1- methyl- 3- (2- phenylethyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: COc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STK587732
Synonyms: 2,4- dichloro- N- (2,3- dihydro- 1,4- benzodioxin- 2- ylmethyl)benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)NCC1COc2c(O1)cccc2

STK587734
Synonyms: 2- (1,3- benzoxazol- 2- ylamino)- 7,7- dimethyl- 4- (3- nitrophenyl)- 4,6,7,8- tetrahydroquinazolin- 5- ol
Smiles: OC1=C2C(=NC(=NC2c2cccc(c2)[N+](=O)[O-])Nc2nc3c(o2)cccc3)CC(C1)(C)C

STK587735
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (3- methoxyphenyl)methylidene]- 5- (4- propoxyphenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)OC

STK587736
Synonyms: 3- [(3,4- dichlorobenzyl)oxy]- 1- hydroxy- 5- methyl- 9H- xanthen- 9- one
Smiles: Clc1ccc(cc1Cl)COc1cc(O)c2c(c1)oc1c(c2=O)cccc1C

STK587737
Synonyms: (5Z)- 1- (4- chlorophenyl)- 5- {[2,5- dimethyl- 1- (quinolin- 6- yl)- 1H- pyrrol- 3- yl]methylidene}- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: Clc1ccc(cc1)N1C(=NC(=O)/C(=C/c2cc(n(c2C)c2ccc3c(c2)cccn3)C)/C1=O)S

STK587739
Synonyms: 4- chloro- N- [4- (4- chlorophenyl)- 6- methyl- 5- oxo- 2- phenyl- 2,5- dihydropyridazin- 3- yl]benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1c(c2ccc(cc2)Cl)c(=O)c(nn1c1ccccc1)C

STK587740
Synonyms: (5E)- 1- (4- chlorophenyl)- 5- ({[3- (1H- imidazol- 1- yl)propyl]amino}methylidene)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: Clc1ccc(cc1)N1C(=NC(=O)/C(=C\NCCCn2ccnc2)/C1=O)S

STK587741
Synonyms: 5- (2- hydroxy- 4- methylphenyl)- N- [(2E)- 6- methoxy- 1,3- benzothiazol- 2(3H)- ylidene]- 1H- pyrazole- 3- carboxamide
Smiles: COc1ccc2c(c1)s/c(=N/C(=O)c1n[nH]c(c1)c1ccc(cc1O)C)/[nH]2

STK587742
Synonyms: 1- amino- 4- [(3- methoxyphenyl)amino]- 2- (pyrrolidin- 1- yl)anthracene- 9,10- dione
Smiles: COc1cccc(c1)Nc1cc(N2CCCC2)c(c2c1C(=O)c1ccccc1C2=O)N

STK587743
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)- 3- (2,4- dimethoxyphenyl)- 6- [2- (3,4- dimethoxyphenyl)ethyl]- 4a,7a,8,8a- tetrahydro- 3aH- 4,8- methano[1,2]oxazolo[4,5- f]isoindole- 5,7(4H,6H)- dione
Smiles: COc1ccc(c(c1)OC)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)CCc1ccc(c(c1)OC)OC

STK587744
Synonyms: 3- (1- phenylethyl)tetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- imine5,5- dioxide
Smiles: CC(N1C(=N)SC2C1CS(=O)(=O)C2)c1ccccc1

STK587745
Synonyms: 2- [7- (4- chlorophenyl)- 5- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]- 3a,4,7,7a- tetrahydro- 1H- isoindole- 1,3(2H)- dione
Smiles: Clc1ccc(cc1)C1C=C(N=c2n1nc([nH]2)N1C(=O)C2C(C1=O)CC=CC2)c1ccccc1

STK587747
Synonyms: 6- (2,4- dimethoxyphenyl)- 9- (naphthalen- 1- yl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1ccc(c(c1)OC)C1CC(=C2C(=Nc3n(C2c2cccc4c2cccc4)ncn3)C1)O

STK587749
Synonyms: 1- [(4- methylphenyl)sulfonyl]- N- {(2S)- 4- (methylsulfanyl)- 1- oxo- 1- [(tetrahydrofuran- 2- ylmethyl)amino]butan- 2- yl}piperidine- 4- carboxamide
Smiles: CSCC[C@@H](C(=O)NCC1CCCO1)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C

STK587750
Synonyms: 3- [2- (3,4- dimethoxyphenyl)ethyl]- 10- methyl- 2- propylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: CCCc1nc2c(c(=O)n1CCc1ccc(c(c1)OC)OC)c(=O)c1c(n2C)cccc1

STK587751
Synonyms: (1'R,2'R)- 7'- chloro- 2'- (3- chlorophenyl)- 1'- (2,2- dimethylpropanoyl)- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: Clc1ccc2c(c1)C=CC1N2[C@@H](C(=O)C(C)(C)C)[C@@H]([C@@]21C(=O)c1c(C2=O)cccc1)c1cccc(c1)Cl

STK587752
Synonyms: N- [4- (diethylamino)phenyl]- 2- (3- oxo- 2,3- dihydro- 1H- isoindol- 1- yl)acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CC1NC(=O)c2c1cccc2)CC

STK587753
Synonyms: 4- {[(E)- (4- chlorophenyl)methylidene]amino}- 5- (2- methoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)Cl

STK587755
Synonyms: (3a'S,6a'R)- 5'- (butan- 2- yl)- 7- 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)Nc1c2cccc1Cl

STK587756
Synonyms: (5E)- 6- hydroxy- 3- (4- methoxybenzyl)- 5- [(2- phenyl- 1H- indol- 3- yl)methylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1)CN1C(=O)N=C(/C(=C\c2c([nH]c3c2cccc3)c2ccccc2)/C1=O)O

STK587758
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 7- amine
Smiles: COc1cc(CCNc2ncnc3c2oc2c3c3CCCc3c(n2)CC(C)C)ccc1OC

STK587760
Synonyms: (3R)- N- (morpholin- 4- yl)- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: O=C([C@@H]1CSC2N1C(=O)c1c2cccc1)NN1CCOCC1

STK587762
Synonyms: 4- ({(Z)- [2- (6- methylpyridin- 2- yl)- 1,3- dioxo- 2,3- dihydroisoquinolin- 4(1H)- ylidene]methyl}amino)benzenesulfonamide
Smiles: Cc1cccc(n1)N1C(=O)/C(=C\Nc2ccc(cc2)S(=O)(=O)N)/c2c(C1=O)cccc2

STK587763
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)- 3- (4- methoxyphenyl)- 6- methyl- 4a,7a,8,8a- tetrahydro- 3aH- 4,8- methano[1,2]oxazolo[4,5- f]isoindole- 5,7(4H,6H)- dione
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)C

STK587766
Synonyms: 6- hydroxy- 3- methyl- 8- (3- methylpiperidin- 1- yl)- 7- {2- [(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]ethyl}- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC1CCCN(C1)c1nc2c(n1CCSc1nnnn1c1ccccc1)c(O)nc(=O)n2C

STK587767
Synonyms: 6- [(1,3- benzothiazol- 2- ylsulfanyl)methyl]- 2- [(4,7- dimethylquinazolin- 2- yl)amino]pyrimidin- 4- ol
Smiles: Oc1cc(CSc2nc3c(s2)cccc3)nc(n1)Nc1nc(C)c2c(n1)cc(cc2)C

STK587769
Synonyms: 8- (3,5- dimethylphenyl)- 1- methyl- 3- (3- methylbutyl)- 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)c1cc(C)cc(c1)C)C

STK587770
Synonyms: N- cyclohexyl- 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)NC1CCCCC1

STK587771
Synonyms: (3a'S,6a'R)- 5'- tert- butyl- 7- chloro- 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: CC(C1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cccc1Cl)O

STK587773
Synonyms: 8- [(4- benzylpiperidin- 1- yl)methyl]- 7- (4- fluorobenzyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccc(cc1)Cn1c(CN2CCC(CC2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK587774
Synonyms: 2- ({5- [(1S)- 1- amino- 2- (1H- indol- 3- yl)ethyl]- 1,3,4- oxadiazol- 2- yl}sulfanyl)- N- (2,3- dimethylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1C)C)CSc1nnc(o1)[C@H](Cc1c[nH]c2c1cccc2)N

STK587775
Synonyms: 8- (4- ethylphenyl)- 1,7- dimethyl- 3- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: CCc1ccc(cc1)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK587776
Synonyms: 4- [(2E)- 2- (quinoxalin- 6- ylmethylidene)hydrazinyl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)N/N=C/c1ccc2c(c1)nccn2

STK587778
Synonyms: 7- bromo- 1- (3- ethoxyphenyl)- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Br

STK587779
Synonyms: 3- chloro- N- [(1S)- 3- (methylsulfanyl)- 1- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)propyl]benzamide
Smiles: CSCC[C@@H](c1nnc2n1cccc2)NC(=O)c1cccc(c1)Cl

STK587781
Synonyms: (5E)- 5- [1- (hexylamino)propylidene]- 6- hydroxy- 3- (2- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: CCCCCCN/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/CC

STK587782
Synonyms: 5- (4- chlorophenyl)- 10- (3,4- dihydroxyphenyl)- 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(c3n1C(C)(C)COC3c1ccc(c(c1)O)O)n(C)c(=O)n(c2=O)C

STK587784
Synonyms: N- (3- hydroxypropyl)- 2- [(3- methyl- 6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 1- yl)oxy]propanamide
Smiles: OCCCNC(=O)C(Oc1cc(C)cc2c1c1CCCCc1c(=O)o2)C

STK587786
Synonyms: 9- (4- butylphenyl)- 3- ethyl- 1- methyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: CCCCc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CC

STK587787
Synonyms: 2- {(E)- [4,6- dioxo- 1- (prop- 2- en- 1- yl)- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}hydrazinecarboxamide
Smiles: C=CCN1C(=NC(=O)/C(=C\NNC(=O)N)/C1=O)S

STK587788
Synonyms: 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-])ccc2c1oc(=O)cc2C

STK587789
Synonyms: (4E)- 5- (2- chlorophenyl)- 4- [(4- chlorophenyl)(hydroxy)methylidene]- 1- (furan- 2- ylmethyl)pyrrolidine- 2,3- dione
Smiles: Clc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1Cl)Cc1ccco1)/O

STK587792
Synonyms: 5- (2- bromophenyl)- 4- {[(E)- (9- ethyl- 9H- carbazol- 3- yl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCn1c2ccc(cc2c2c1cccc2)/C=N/n1c(=S)[nH]nc1c1ccccc1Br

STK587795
Synonyms: 5- (4- fluorophenyl)- 4- {[(E)- (3,4,5- trimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(/C=N/n2c(=S)[nH]nc2c2ccc(cc2)F)cc(c1OC)OC

STK587797
Synonyms: N- (2- chloro- 4,6- dimethylphenyl)- 2- {[4- ethyl- 5- (2- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCn1c(SCC(=O)Nc2c(C)cc(cc2Cl)C)nnc1c1ccccc1OC

STK587798
Synonyms: 2- {5- [(4- tert- butylbenzyl)sulfanyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}pyrazine
Smiles: Cc1ccc(cc1)n1c(SCc2ccc(cc2)C(C)(C)C)nnc1c1cnccn1

STK587799
Synonyms: (5Z)- 1- (2- methoxyphenyl)- 5- [5- (4- methoxyphenyl)pyrazolidin- 3- ylidene]pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1)C1NN/C(=C\2/C(=O)NC(=O)N(C2=O)c2ccccc2OC)/C1

STK587800
Synonyms: (3R)- 2,2- dimethyl- 5- oxo- N- (prop- 2- en- 1- yl)- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: C=CCNC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1

STK587801
Synonyms: 4- chloro- N- (2- methoxyethyl)- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzenesulfonamide
Smiles: COCCN(S(=O)(=O)c1ccc(cc1)Cl)Cc1cc2cc(C)ccc2[nH]c1=O

STK587802
Synonyms: N- (2- {7- methoxy- 6- [(E)- (2- {[(1S,2S)- 2- phenylcyclopropyl]carbonyl}hydrazinylidene)methyl]- 1,3- benzodioxol- 5- yl}ethyl)- N- methylacetamide
Smiles: COc1c(/C=N/NC(=O)[C@H]2C[C@@H]2c2ccccc2)c(CCN(C(=O)C)C)cc2c1OCO2

STK587803
Synonyms: 2- (5,9- dimethyl- 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: CN1CCc2c(C1)sc1c2c2nc(nn2c(n1)C)c1ccccc1O

STK587806
Synonyms: 3- (3- chlorophenyl)- 2- [(2- hydroxyethyl)amino]- 3,5,6,7,8,9- hexahydro- 4H- cyclohepta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: OCCNc1nc2sc3c(c2c(=O)n1c1cccc(c1)Cl)CCCCC3

STK587809
Synonyms: (5Z)- 4- hydroxy- 5- (3,4,5- trimethoxybenzylidene)- 1,3- thiazol- 2(5H)- one
Smiles: COc1cc(/C=C/2\SC(=O)N=C2O)cc(c1OC)OC

STK587810
Synonyms: 2- [(3a'S,6a'R)- 5'- tert- butyl- 5- fluoro- 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)C(C)(C)C)C(=O)Nc1c2cc(F)cc1

STK587813
Synonyms: 3,4,5- triethoxy- N- [(2Z)- 5- (3- methylphenyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]benzamide
Smiles: CCOc1cc(cc(c1OCC)OCC)C(=O)/N=c\1/[nH]nc(s1)c1cccc(c1)C

STK587814
Synonyms: 8,8- dimethyl- 5- (phenylamino)- 3- [(2- phenylethyl)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(c1Nc1ccccc1)c(SCCc1ccccc1)nn2

STK587816
Synonyms: (5E)- 5- {[1- (2- fluorobenzyl)- 1H- indol- 3- yl]methylidene}- 3- (furan- 2- ylmethyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: OC1=NC(=O)N(C(=O)/C/1=C/c1cn(c2c1cccc2)Cc1ccccc1F)Cc1ccco1

STK587818
Synonyms: 2- ({4- amino- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1cccc(c1)OC

STK587819
Synonyms: 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]- N- [4- (propan- 2- yl)phenyl]hexanamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK587821
Synonyms: 1- (4- fluorophenyl)- 2- {[4- (4- methylphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}ethanone
Smiles: Cc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)F)nnc1c1ccccn1

STK587823
Synonyms: 9- [2- (3,4- dimethoxyphenyl)ethyl]- 1- methyl- 3- (prop- 2- en- 1- yl)- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: C=CCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)CCc1ccc(c(c1)OC)OC

STK587826
Synonyms: 10- methyl- 3- (3- methylbutyl)- 2- (thiophen- 2- yl)pyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: CC(CCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1cccs1)C

STK587827
Synonyms: (5Z)- 3- (4- chlorophenyl)- 6- hydroxy- 5- [5- (4- hydroxy- 3- methoxyphenyl)pyrazolidin- 3- ylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1cc(ccc1O)C1NN/C(=C\2/C(=NC(=O)N(C2=O)c2ccc(cc2)Cl)O)/C1

STK587828
Synonyms: 8- (3- chlorophenyl)- 1- methyl- 3- (3- methylbenzyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: Cc1cccc(c1)Cn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1cccc(c1)Cl

STK587829
Synonyms: 3- [(3- fluorobenzyl)oxy]- 1- hydroxy- 5- methyl- 9H- xanthen- 9- one
Smiles: Fc1cccc(c1)COc1cc(O)c2c(c1)oc1c(c2=O)cccc1C

STK587831
Synonyms: 3- (3- chlorophenyl)- 5- [(4- methoxybenzyl)sulfanyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazole
Smiles: COc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK587834
Synonyms: 10- methyl- 3- (4- methylphenyl)- 2- (propan- 2- yl)pyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: Cc1ccc(cc1)n1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)C(C)C

STK587835
Synonyms: 1- hydroxy- 5- methyl- 9- oxo- 9H- xanthen- 3- ylN- [(benzyloxy)carbonyl]- D- valinate
Smiles: O=C(N[C@@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C)C(C)C)OCc1ccccc1

STK587836
Synonyms: 4- {(2E)- 2- [(1- benzyl- 3,5- dimethyl- 1H- pyrazol- 4- yl)methylidene]hydrazinyl}- 5- phenylthieno[2,3- d]pyrimidine
Smiles: Cc1nn(c(c1/C=N/Nc1ncnc2c1c(cs2)c1ccccc1)C)Cc1ccccc1

STK587839
Synonyms: 2- chloro- 3- ethenyl- 7- methoxyquinoline
Smiles: COc1ccc2c(c1)nc(c(c2)C=C)Cl

STK587840
Synonyms: (3a'S,6a'R)- 5'- (3- chloro- 4- fluorophenyl)- 5- fluoro- 3'- (1H- indol- 3- ylmethyl)- 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)c1ccc(c(c1)Cl)F)Cc1c[nH]c3c1cccc3)C(=O)N2

STK587841
Synonyms: 9- methoxy- 6- [2- oxo- 2- (pyrrolidin- 1- yl)ethyl]- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 5(6H)- one
Smiles: COc1ccc2c(c1)c1nc3SCCn3c(=O)c1n2CC(=O)N1CCCC1

STK587842
Synonyms: N- (5- chloro- 2- methoxyphenyl)- 2- {[3- cyano- 4- (furan- 2- yl)- 5- hydroxy- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(Cl)ccc2OC)N=C2C(=C(O)CCC2)C1c1ccco1

STK587843
Synonyms: 7- (5- chloro- 2- methoxyphenyl)- 3- (4- chlorophenyl)- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: COc1ccc(cc1N1C(=O)CC2(C1=O)ON=C(C2)c1ccc(cc1)Cl)Cl

STK587845
Synonyms: (4E)- 5- (4- bromophenyl)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 1- (5- methyl- 1,3,4- thiadiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: Brc1ccc(cc1)C1N(c2nnc(s2)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK587846
Synonyms: N- [(2Z)- 3- (3,4- dimethoxybenzyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]propanamide
Smiles: CCC(=O)/N=C/1\SC2C(N1Cc1ccc(c(c1)OC)OC)CS(=O)(=O)C2

STK587848
Synonyms: (1Z)- 5- (2,4- dichlorophenoxy)- 1- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 1(2H)- ylidene)pentan- 2- one
Smiles: COc1cc2/C(=C/C(=O)CCCOc3ccc(cc3Cl)Cl)/NCCc2cc1OC

STK587849
Synonyms: (5Z)- 5- {1- [(furan- 2- ylmethyl)amino]ethylidene}- 6- hydroxy- 3- (4- methoxyphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C(/NCc2ccco2)\C)/C1=O)O

STK587850
Synonyms: (5Z)- 6- hydroxy- 3- phenyl- 5- (1- {[2- (piperazin- 1- yl)ethyl]amino}propylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1)O)/NCCN1CCNCC1

STK587851
Synonyms: 9- methyl- 3- {(Z)- [4- oxo- 3- (3- phenylpropyl)- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (pyrrolidin- 1- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: S=C1S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCCC2)/C(=O)N1CCCc1ccccc1

STK587853
Synonyms: N'- (8- benzyl- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- yl)- N,N- dimethylethane- 1,2- diamine
Smiles: CN(CCNc1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1)C

STK587854
Synonyms: 8- amino- 1',3'- dimethyl- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrido[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: Nc1ccc2c(c1)CC1(C3N2CCCC3)C(=O)N(C)C(=O)N(C1=O)C

STK587856
Synonyms: methyl4- ({[(6- chloro- 4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]acetyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)COc1cc2oc(=O)cc(c2cc1Cl)C

STK587858
Synonyms: (2E,5Z)- 2- [(4- fluorophenyl)imino]- 5- [(1- methyl- 1H- pyrrol- 2- yl)methylidene]- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: Fc1ccc(cc1)/N=C\1/S/C(=C\c2cccn2C)/C(=N1)O

STK587859
Synonyms: 8- (4- ethoxyphenyl)- 1- methyl- 3- (2- methylbenzyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1C

STK587860
Synonyms: 9- (3,5- dimethylphenyl)- 1- methyl- 3- propyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: CCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1cc(C)cc(c1)C

STK587861
Synonyms: 8- (3,4- dimethylphenyl)- 1- methyl- 3- (3- methylbutyl)- 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)c1ccc(c(c1)C)C)C

STK587862
Synonyms: 2- ({4- (4- ethoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- fluorophenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)F)nnc1COc1ccc(cc1)C

STK587863
Synonyms: 3- (2,4- dichlorobenzyl)- 8- (2- methoxyethyl)- 1,7- dimethyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COCCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1Cl)Cl

STK587864
Synonyms: ethyl[2- (4- chlorophenyl)- 7- hydroxy- 5- methylpyrazolo[1,5- a]pyrimidin- 6- yl]acetate
Smiles: CCOC(=O)Cc1c(C)nc2n(c1O)nc(c2)c1ccc(cc1)Cl

STK587865
Synonyms: 2- ({5- [(1S)- 1- aminoethyl]- 1,3,4- oxadiazol- 2- yl}sulfanyl)- 1- (4- chlorophenyl)ethanone
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc(o1)[C@@H](N)C

STK587866
Synonyms: 1- (3- bromophenyl)- 4- (4- hydroxy- 3- methoxyphenyl)- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: COc1cc(ccc1O)C1CC(=O)N(C2=C1C(=O)OC2)c1cccc(c1)Br

STK587868
Synonyms: 2- [3- (4- chlorophenyl)- 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)Cl)C

STK587870
Synonyms: 3'- (3- chlorophenyl)- 6'- hydroxy- 2,4- dimethyl- 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)c1cccc(c1)Cl)O)[N+](=O)[O-]

STK587871
Synonyms: 8- bromo- N- (propan- 2- yl)[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: CC(Nc1ncnc2c1oc1c2cc(cc1)Br)C

STK587872
Synonyms: 4- methyl- N- (3- methylphenyl)- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzenesulfonamide
Smiles: Cc1cccc(c1)N(S(=O)(=O)c1ccc(cc1)C)Cc1cc2ccccc2[nH]c1=O

STK587873
Synonyms: 5- {4- [(4- methylbenzyl)oxy]phenyl}- N'- [(E)- phenylmethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: Cc1ccc(cc1)COc1ccc(cc1)c1[nH]nc(c1)C(=O)N/N=C/c1ccccc1

STK587874
Synonyms: N- [7- (4- fluorophenyl)- 5- phenyl- 4,5,6,7- tetrahydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]propanamide
Smiles: CCC(=O)Nc1nn2c(n1)NC(CC2c1ccc(cc1)F)c1ccccc1

STK587875
Synonyms: 4- hydroxy- 1- methyl- 8- [2- (morpholin- 4- yl)ethyl]- 7- phenyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Oc1nc(=O)n(c2c1n1cc(n(c1n2)CCN1CCOCC1)c1ccccc1)C

STK587877
Synonyms: N- (7- methyl- 2,3- dihydro- 1H- pyrrolo[2,3- b]quinolin- 1- yl)propanamide
Smiles: CCC(=O)NN1CCc2c1nc1cc(C)ccc1c2

STK587878
Synonyms: 2- [(3aR,4R,4aR,7aS,8R,8aR)- 3- (4- chlorophenyl)- 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- methylpentanoicacid
Smiles: CC(CC(N1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1C[C@H]2[C@H]2[C@@H]1ON=C2c1ccc(cc1)Cl)C(=O)O)C

STK587879
Synonyms: 3,4,5- trimethoxy- N- (2- methoxyethyl)- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: COCCN(C(=O)c1cc(OC)c(c(c1)OC)OC)Cc1cc2ccccc2[nH]c1=O

STK587882
Synonyms: 1- (3,4- dichlorophenyl)- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccc(c(c1)Cl)Cl)c(=O)c1c(o2)cccc1

STK587883
Synonyms: (4E)- 4- {[(1,1- dioxidotetrahydrothiophen- 3- yl)amino]methylidene}- 2- (3- methoxyphenyl)isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1cccc(c1)N1C(=O)/C(=C/NC2CCS(=O)(=O)C2)/c2c(C1=O)cccc2

STK587884
Synonyms: 2- (4,6- dimethylpyrimidin- 2- yl)- 4- hydroxy- 6- methyl- 5- (3- methylbenzyl)- 1,2- dihydro- 3H- pyrazolo[3,4- b]pyridin- 3- one
Smiles: Cc1cccc(c1)Cc1c(C)nc2c(c1O)c(=O)n([nH]2)c1nc(C)cc(n1)C

STK587886
Synonyms: N'- {(E)- [1- (4- fluorobenzyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}heptanehydrazide
Smiles: CCCCCCC(=O)NN/C=C/1\C(=NC(=O)N(C1=O)Cc1ccc(cc1)F)O

STK587887
Synonyms: (2,3- dimethoxy- 6H- indolo[2,3- b]quinoxalin- 6- yl)acetonitrile
Smiles: N#CCn1c2ccccc2c2c1nc1cc(OC)c(cc1n2)OC

STK587890
Synonyms: 4- {[(E)- (5- bromo- 2- methoxyphenyl)methylidene]amino}- 5- (3- chlorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1/C=N/n1c(=S)[nH]nc1c1cccc(c1)Cl)Br

STK587891
Synonyms: 5- (3- 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]nc1c1cccc(c1)Cl

STK587894
Synonyms: 3- (1,3- benzodioxol- 5- ylmethyl)- 1',3'- dipropyl- 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: CCCN1C(=O)N(CCC)C(=O)C2(C1=O)Cc1ccccc1N1C2CN(CC1)Cc1ccc2c(c1)OCO2

STK587895
Synonyms: 4- methoxy- N- (4- methoxyphenyl)- N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzenesulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)OC)Cc1cc2cccc(c2[nH]c1=O)C

STK587896
Synonyms: 3- (pyridin- 4- ylmethyl)- 3,4,8,9- tetrahydro- 2H- cyclopenta[3,4]chromeno[8,7- e][1,3]oxazin- 6(7H)- one
Smiles: O=c1oc2c3CN(COc3ccc2c2c1CCC2)Cc1ccncc1

STK587897
Synonyms: 6- [2- (4- chlorophenoxy)ethyl]- 7,10- dimethyl- 6H- indolo[2,3- b]quinoxaline
Smiles: Clc1ccc(cc1)OCCn1c2nc3ccccc3nc2c2c1c(C)ccc2C

STK587898
Synonyms: 6- hydroxy- 3- methyl- 7- {2- methyl- 3- [(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]propyl}- 8- (morpholin- 4- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(Cn1c(nc2c1c(O)nc(=O)n2C)N1CCOCC1)CSc1nnnn1c1ccccc1

STK587899
Synonyms: 2- [14- (pyridin- 3- yl)- 14H- benzo[7,8]chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]aniline
Smiles: Nc1ccccc1c1nc2n(n1)cnc1c2C(c2cccnc2)c2c(O1)c1ccccc1cc2

STK587900
Synonyms: N- [4- (benzyloxy)phenyl]- 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(cc1)OCc1ccccc1

STK587901
Synonyms: 3- [(8- propyl- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- yl)amino]propan- 1- ol
Smiles: CCCN1CCc2c(C1)sc1c2c(NCCCO)nc2n1nnn2

STK587903
Synonyms: (5s,7s)- 2- (5- bromo- 2- hydroxyphenyl)- 5- ethyl- 7- methyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: CC[C@]12CN3C[C@@](C2=O)(CN(C1)C3c1cc(Br)ccc1O)C

STK587904
Synonyms: (5E)- 5- ({[3- (dimethylamino)propyl]amino}methylidene)- 6- hydroxy- 3- (4- methoxyphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C\NCCCN(C)C)/C1=O)O

STK587905
Synonyms: (5Z)- 5- {[5- (2- chlorophenyl)furan- 2- yl]methylidene}- 2- [(E)- 2- (4- methoxyphenyl)ethenyl][1,3]thiazolo[3,2- b][1,2,4]triazol- 6(5H)- one
Smiles: COc1ccc(cc1)/C=C/c1nn2c(n1)s/c(=C\c1ccc(o1)c1ccccc1Cl)/c2=O

STK587906
Synonyms: N- [(2,5- dimethylphenyl)carbamoyl]- L- alanine
Smiles: O=C(Nc1cc(C)ccc1C)N[C@H](C(=O)O)C

STK587907
Synonyms: (4- hydroxyphthalazin- 1- yl)aceticacid
Smiles: OC(=O)Cc1nnc(c2c1cccc2)O

STK587908
Synonyms: (3a'S,6a'R)- 3'- (1H- indol- 3- ylmethyl)- 5'- (3- methoxyphenyl)- 7- 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: COc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cccc2C

STK587911
Synonyms: N- [(2E)- 3- [4- (dimethylamino)phenyl]- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- ethylbutanamide
Smiles: CCC(C(=O)/N=C\1/SC2C(N1c1ccc(cc1)N(C)C)CS(=O)(=O)C2)CC

STK587913
Synonyms: (5E)- 5- (3- bromo- 4,5- diethoxybenzylidene)- 6- hydroxy- 3- (prop- 2- en- 1- yl)pyrimidine- 2,4(3H,5H)- dione
Smiles: C=CCN1C(=O)N=C(/C(=C\c2cc(Br)c(c(c2)OCC)OCC)/C1=O)O

STK587914
Synonyms: 10- (3,4- dimethoxyphenyl)- 1,3- dimethyl- 5- (4- methylphenyl)- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: COc1ccc(cc1OC)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1ccc(cc1)C)C

STK587915
Synonyms: 7- (prop- 2- en- 1- ylsulfanyl)- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidine
Smiles: C=CCSc1nnc2n1c1sc3c(c1c1n2ncn1)CCCC3

STK587917
Synonyms: 2- ({5- [(4- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)- N- (3- chloro- 4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)C)CSc1nnc(s1)SCc1ccc(cc1)Cl

STK587919
Synonyms: tert- butyl(2S)- 2- [5- ({2- [(2,6- dimethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 1,3,4- oxadiazol- 2- yl]pyrrolidine- 1- carboxylate
Smiles: O=C(Nc1c(C)cccc1C)CSc1nnc(o1)[C@@H]1CCCN1C(=O)OC(C)(C)C

STK587921
Synonyms: 2- (4- fluorophenyl)- 5,6,10,11- tetrahydro- 9H- [1,4]dioxepino[2,3- g]pyrrolo[2,1- a]isoquinoline
Smiles: Fc1ccc(cc1)c1cn2c(c1)c1cc3OCCCOc3cc1CC2

STK587923
Synonyms: 4- ({(E)- [2- (trifluoromethyl)phenyl]methylidene}amino)- 5- (3,4,5- trimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1ccccc1C(F)(F)F

STK587924
Synonyms: 5- (furan- 2- yl)- 4- imino- 3- [3- (morpholin- 4- yl)propyl]- 3,5- dihydro- 4H- chromeno[2,3- d]pyrimidin- 8- ol
Smiles: Oc1ccc2c(c1)Oc1c(C2c2ccco2)c(=N)n(cn1)CCCN1CCOCC1

STK587927
Synonyms: 2- chloro- 5- (5- {(Z)- [2- hydroxy- 1- (4- methylbenzyl)- 5- oxo- 1,5- dihydro- 4H- imidazol- 4- ylidene]methyl}furan- 2- yl)benzoicacid
Smiles: Cc1ccc(cc1)CN1C(=N/C(=C\c2ccc(o2)c2ccc(c(c2)C(=O)O)Cl)/C1=O)O

STK587928
Synonyms: 2- (3- bromophenyl)- 3- (furan- 2- ylmethyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: Brc1cccc(c1)c1nc2oc3ccccc3c(=O)c2c(=O)n1Cc1ccco1

STK587932
Synonyms: N- [(2Z)- 5,5- dioxido- 3- (2,4,6- trimethylphenyl)tetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]butanamide
Smiles: CCCC(=O)/N=C/1\SC2C(N1c1c(C)cc(cc1C)C)CS(=O)(=O)C2

STK587934
Synonyms: 4- methyl- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- phenylbenzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N(c1ccccc1)Cc1cc2ccc(cc2[nH]c1=O)C

STK587935
Synonyms: (2E)- 2- [(2E)- (4- butoxy- 3- methoxybenzylidene)hydrazinylidene]- 5- methyl- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: CCCCOc1ccc(cc1OC)/C=N/N=C/1\N=C(C(S1)C)O

STK587937
Synonyms: 4- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]- N- (4- fluorophenyl)benzamide
Smiles: Fc1ccc(cc1)NC(=O)c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK587938
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK587939
Synonyms: 5- methyl- N- [3- (morpholin- 4- yl)propyl]- 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(nc2C)sc2c1CCCC2)NCCCN1CCOCC1

STK587940
Synonyms: (3aR,6aS)- 5- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 3- (3,4- dimethoxyphenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: COc1ccc(cc1OC)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc2c(c1)OCCO2

STK587941
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(3- methoxyphenyl)carbonyl]- 2'- {[4- (2- methylpropyl)phenyl]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)c1ccc(cc1)CC(C)C)C(=O)Nc1c2cccc1)cccc3

STK587942
Synonyms: 3- benzyl- 1'- (propan- 2- yl)- 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: CC(N1C(=O)NC(=O)C2(C1=O)Cc1ccccc1N1C2CN(CC1)Cc1ccccc1)C

STK587943
Synonyms: (4- {[5- chloro- 6- oxo- 1- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 1,6- dihydropyridazin- 4- yl]amino}phenyl)aceticacid
Smiles: OC(=O)Cc1ccc(cc1)Nc1cnn(c(=O)c1Cl)C12CC3CC(C2)CC(C1)C3

STK587944
Synonyms: N- (3- hydroxypropyl)- 1- (3- methoxypropyl)- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: OCCCNC(=O)c1cc2c(n1CCCOC)nc1n(c2=O)cccc1

STK587948
Synonyms: 1- {(2E)- 2- [(2- chloro- 8- methylquinolin- 3- yl)methylidene]hydrazinyl}- 2- ethyl- 3- methylpyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(c1N/N=C/c1cc3cccc(c3nc1Cl)C)c1ccccc1n2

STK587949
Synonyms: 8- (4- ethylpiperazin- 1- yl)- 1,3- dimethyl- 7- [2- (pyrimidin- 2- ylsulfanyl)ethyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCN1CCN(CC1)c1nc2c(n1CCSc1ncccn1)c(=O)n(c(=O)n2C)C

STK587950
Synonyms: (5E)- 5- (1- {[3- (diethylamino)propyl]amino}ethylidene)- 6- hydroxy- 3- (2- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: CCN(CCCN/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/C)CC

STK587951
Synonyms: 2- (2- fluorophenyl)- 4- imino- 6,7- dihydro- 4H- [1,3]dioxolo[4,5- g]pyrido[2,1- a]isoquinoline- 3- carbonitrile
Smiles: N#Cc1c(cc2n(c1=N)CCc1c2cc2OCOc2c1)c1ccccc1F

STK587952
Synonyms: N- [3- (dimethylamino)propyl]- 2- oxo- 2H- chromene- 3- carboxamide
Smiles: CN(CCCNC(=O)c1cc2ccccc2oc1=O)C

STK587953
Synonyms: 6- [(E)- (1,3- dihydro- 2H- benzimidazol- 2- ylidenehydrazinylidene)methyl]quinoxaline
Smiles: N(=C\c1ccc2c(c1)nccn2)/N=c/1\[nH]c2c([nH]1)cccc2

STK587954
Synonyms: N- [3- (dimethylamino)propyl]- 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(nc2)sc2c1CCC2)C

STK587956
Synonyms: 3- (furan- 2- ylmethyl)- 2- propyl- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: CCCc1nc2oc3ccccc3c(=O)c2c(=O)n1Cc1ccco1

STK587957
Synonyms: (2Z)- 1- (4- methylphenyl)- 2- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 7(8H)- ylidene)ethanone
Smiles: Cc1ccc(cc1)C(=O)/C=C/1\NCCc2c1cc1OCCCOc1c2

STK587958
Synonyms: N- (2,5- dichlorophenyl)- 2- {[4- phenyl- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)ccc1Cl)CSc1nnc(n1c1ccccc1)c1cnccn1

STK587959
Synonyms: (1S,2S)- N'- {(E)- [1- (4- fluorobenzyl)- 1H- indol- 3- yl]methylidene}- 2- phenylcyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1cn(c2c1cccc2)Cc1ccc(cc1)F

STK587960
Synonyms: N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (pyridin- 3- ylmethyl)acetamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)C)Cc1cccnc1

STK587961
Synonyms: 4- (3,4- dimethylphenyl)- N- (2- methoxyphenyl)- 1- (4- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1ccccc1NC(=O)c1c(c2ccc(cc2)C)c2c3n1cc(n3CCCC2)c1ccc(c(c1)C)C

STK587962
Synonyms: 1'- (3,5- dimethoxybenzyl)- 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: COc1cc(cc(c1)OC)CN1C(=O)NC(=O)C2(C1=O)Cc1ccccc1N1C2CN(C)CC1

STK587963
Synonyms: 4- nitro- N- [(3Z)- 1- propyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]benzenesulfonamide
Smiles: CCCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])/c2c1nc1ccccc1c2

STK587964
Synonyms: 4- fluoro- N- methyl- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzenesulfonamide
Smiles: Fc1ccc(cc1)S(=O)(=O)N(Cc1cc2ccc(cc2[nH]c1=O)C)C

STK587965
Synonyms: 1- ethyl- 4- [(2- hydroxypropyl)amino]- 3- nitroquinolin- 2(1H)- one
Smiles: CCn1c2ccccc2c(c(c1=O)[N+](=O)[O-])NCC(O)C

STK587966
Synonyms: 4- [(2E)- 2- {4- methoxy- 3- [(3- methoxyphenoxy)methyl]benzylidene}hydrazinyl]- 5- phenylthieno[2,3- d]pyrimidine
Smiles: COc1ccc(cc1COc1cccc(c1)OC)/C=N/Nc1ncnc2c1c(cs2)c1ccccc1

STK587967
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 1- {5- [(2- fluorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}- 5- [3- (pentyloxy)phenyl]pyrrolidine- 2,3- dione
Smiles: CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccccc1F

STK587969
Synonyms: 1- (2- fluorophenyl)- 2,7- dimethyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccc1F)C

STK587970
Synonyms: 5- (2- methoxyphenyl)- 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]nc1c1ccccc1OC)OC

STK587971
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,6- dimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cccc1C)CSc1nnc(n1c1ccc(cc1)Cl)Cc1cccs1

STK587972
Synonyms: N- [3- (butanoylamino)- 4- chlorophenyl]- 4- methoxybenzamide
Smiles: CCCC(=O)Nc1cc(ccc1Cl)NC(=O)c1ccc(cc1)OC

STK587973
Synonyms: N- (4- bromo- 3- methylphenyl)- 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]hexanamide
Smiles: O=C(Nc1ccc(c(c1)C)Br)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK587975
Synonyms: 2- hydroxy- 3- {[(E)- (2- hydroxyphenyl)methylidene]amino}- 7- methoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)[nH]c1c2nc(n(c1=O)/N=C/c1ccccc1O)O

STK587976
Synonyms: 3- (2- fluorobenzyl)- 1- methyl- 8- (2- methylphenyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: Fc1ccccc1Cn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1C

STK587978
Synonyms: N- (3- hydroxypropyl)- 5,10,10- trimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: OCCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CC(C)(C)OC2

STK587979
Synonyms: (1Z)- 6,7- dimethoxy- 1- [(phenylsulfonyl)methylidene]- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1cc2c(cc1OC)CCN/C/2=C\S(=O)(=O)c1ccccc1

STK587981
Synonyms: N- {4- [(3a'S,6a'R)- 5- chloro- 3'- (1H- indol- 3- ylmethyl)- 7- 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]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cc(Cl)cc2C

STK587982
Synonyms: (5E)- 6- hydroxy- 5- [(6- hydroxy- 4- oxo- 4H- chromen- 3- yl)methylidene]- 3- phenylpyrimidine- 2,4(3H,5H)- dione
Smiles: Oc1ccc2c(c1)c(=O)c(co2)/C=C/1\C(=NC(=O)N(C1=O)c1ccccc1)O

STK587983
Synonyms: 1- (10H- phenothiazin- 10- yl)- 2- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)ethanone
Smiles: O=C(N1c2ccccc2Sc2c1cccc2)CN1CCc2c(C1)cc1c(c2)OCCCO1

STK587984
Synonyms: (5E)- 3- benzyl- 5- (1- {[2- (dimethylamino)ethyl]amino}propylidene)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)O)/NCCN(C)C

STK587986
Synonyms: 2- methoxy- N- [3- (4- methylphenyl)- 4- oxo- 4H- thiochromen- 2- yl]benzamide
Smiles: COc1ccccc1C(=O)Nc1sc2ccccc2c(=O)c1c1ccc(cc1)C

STK587987
Synonyms: N- (2- chlorophenyl)- 3- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanamide
Smiles: O=C(Nc1ccccc1Cl)CCn1nnc2c(c1=O)cccc2

STK587988
Synonyms: methyl(2E)- 4- methyl- 2- ({[5- (2- nitrophenyl)furan- 2- yl]carbonyl}imino)- 2,3- dihydro- 1,3- thiazole- 5- carboxylate
Smiles: COC(=O)c1s/c(=N/C(=O)c2ccc(o2)c2ccccc2[N+](=O)[O-])/[nH]c1C

STK587991
Synonyms: N- (2- cyanoethyl)- 5,6- dimethoxy- N- methyl- 1H- indole- 2- carboxamide
Smiles: N#CCCN(C(=O)c1cc2c([nH]1)cc(c(c2)OC)OC)C

STK587994
Synonyms: 7- chloro- 6- methyl- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- (4- nitrophenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccc(cc1)[N+](=O)[O-])c(=O)c1c(o2)cc(c(c1)Cl)C

STK587995
Synonyms: (2E,5E)- 5- (3- hydroxybenzylidene)- 2- [(4- hydroxyphenyl)imino]- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: Oc1ccc(cc1)/N=C/1\N=C(/C(=C\c2cccc(c2)O)/S1)O

STK587996
Synonyms: 3- (3- bromo- 4- fluorophenyl)- 5- (3- chlorophenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: Clc1cccc(c1)N1C(=O)C2C(C1=O)ON(C2c1ccc(c(c1)Br)F)c1ccccc1

STK587997
Synonyms: 1- benzyl4- (4- ethyl- 2- oxo- 2H- chromen- 7- yl)piperidine- 1,4- dicarboxylate
Smiles: CCc1cc(=O)oc2c1ccc(c2)OC(=O)C1CCN(CC1)C(=O)OCc1ccccc1

STK587999
Synonyms: N- {[2- ({4- (3,4- dimethoxyphenyl)- 5- methyl- 2- [(phenylcarbonyl)amino]thiophen- 3- yl}carbonyl)hydrazinyl]carbonothioyl}benzamide
Smiles: COc1ccc(cc1OC)c1c(C)sc(c1C(=O)NNC(=S)NC(=O)c1ccccc1)NC(=O)c1ccccc1

STK588000
Synonyms: N'- [(1E)- 1- (biphenyl- 4- yl)ethylidene]- 5- (naphthalen- 1- yl)- 1H- pyrazole- 3- carbohydrazide
Smiles: C/C(=N\NC(=O)c1n[nH]c(c1)c1cccc2c1cccc2)/c1ccc(cc1)c1ccccc1

STK588001
Synonyms: 7- [2- (1,3- benzothiazol- 2- ylsulfanyl)ethyl]- 1,3- dimethyl- 8- (2- methylpiperidin- 1- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC1CCCCN1c1nc2c(n1CCSc1nc3c(s1)cccc3)c(=O)n(c(=O)n2C)C

STK588002
Synonyms: methyl4- oxo- 3- (4- sulfamoylbenzyl)- 2- sulfanyl- 3,4- dihydroquinazoline- 7- carboxylate
Smiles: COC(=O)c1ccc2c(c1)nc(n(c2=O)Cc1ccc(cc1)S(=O)(=O)N)S

STK588003
Synonyms: N- benzyl- 5- (5- chloro- 2- hydroxyphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: Clc1ccc(c(c1)c1[nH]nc(c1)C(=O)NCc1ccccc1)O

STK588004
Synonyms: N- (2,6- dimethylphenyl)- 2- {[4- phenyl- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1c(C)cccc1C)CSc1nnc(n1c1ccccc1)c1ccccn1

STK588006
Synonyms: 10- (furan- 2- yl)- 1,3- dimethyl- 5- (4- methylphenyl)- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: Cc1ccc(cc1)c1n2CCOC(c2c2c1c(=O)n(C)c(=O)n2C)c1ccco1

STK588007
Synonyms: 14- (3- bromophenyl)- 3,3- dimethyl- 2,3,4,6,7,14- hexahydro- 1H- [1,3]dioxolo[6,7]isoquino[2,1- a]quinolin- 1- one
Smiles: Brc1cccc(c1)C1C=C2N(C3=C1C(=O)CC(C3)(C)C)CCc1c2cc2OCOc2c1

STK588009
Synonyms: N- (3- methoxyphenyl)- 1,4- diphenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1cccc(c1)NC(=O)c1c(c2ccccc2)c2c3n1cc(n3CCCC2)c1ccccc1

STK588010
Synonyms: 2- [(3a'S,6a'R)- 6- chloro- 5'- (2- chlorobenzyl)- 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]acetamide
Smiles: NC(=O)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2ccc(c1C)Cl

STK588011
Synonyms: (5s,7s)- 2- (4- chlorophenyl)- 5- ethyl- 7- methyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: CC[C@]12CN3C[C@@](C2=O)(CN(C1)C3c1ccc(cc1)Cl)C

STK588012
Synonyms: 4- phenyl- 9- (pyridin- 2- ylmethyl)- 9,10- dihydro- 2H,8H- chromeno[8,7- e][1,3]oxazin- 2- one
Smiles: O=c1oc2c3CN(COc3ccc2c(c1)c1ccccc1)Cc1ccccn1

STK588015
Synonyms: 1- tert- butyl4- (2- oxo- 4- propyl- 2H- chromen- 7- yl)piperidine- 1,4- dicarboxylate
Smiles: CCCc1cc(=O)oc2c1ccc(c2)OC(=O)C1CCN(CC1)C(=O)OC(C)(C)C

STK588016
Synonyms: (3a'R,8b'S)- 2'- butyl- 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: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(N3C2CCC3)C(=O)Nc2c1cccc2CC

STK588017
Synonyms: 3- (2- chlorobenzyl)- 9- (4- fluorophenyl)- 1- methyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: Fc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1Cl

STK588018
Synonyms: 9- (4- ethoxyphenyl)- 7- hydroxy- 1- methyl- 3- (2- phenylethyl)- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: CCOc1ccc(cc1)N1CC(O)Cn2c1nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STK588019
Synonyms: (4E)- 1- (6- fluoro- 1,3- benzothiazol- 2- yl)- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 5- [4- (prop- 2- en- 1- yloxy)phenyl]pyrrolidine- 2,3- dione
Smiles: C=CCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)F

STK588020
Synonyms: N- [4- (diethylamino)phenyl]- 2- {[5- (2- methoxyphenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)c1ccccc1OC)CC

STK588021
Synonyms: N'- [(1Z)- 3- amino- 1H- isoindol- 1- ylidene]pyridine- 2- carbohydrazide
Smiles: O=C(c1ccccn1)N/N=C/1\N=C(c2c1cccc2)N

STK588022
Synonyms: 5,6- dimethyl- 2- (4- phenylpiperazin- 1- yl)pyrimidin- 4- ol
Smiles: Cc1nc(nc(c1C)O)N1CCN(CC1)c1ccccc1

STK588023
Synonyms: 12- chloro- 3- (pyridin- 2- ylmethyl)- 3,4,7,8,9,10- hexahydro- 2H,6H- benzo[3,4]chromeno[8,7- e][1,3]oxazin- 6- one
Smiles: Clc1cc2c(c3c1OCN(C3)Cc1ccccn1)oc(=O)c1c2CCCC1

STK588024
Synonyms: 2- (4- chlorophenyl)- 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)c1ccc(cc1)Cl

STK588025
Synonyms: 1- [2- (furan- 2- yl)- 8- methyl- 10- phenyl- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- yl]ethanone
Smiles: CC(=O)C1=C(C)Oc2c(C1c1ccccc1)c1nc(nn1cn2)c1ccco1

STK588026
Synonyms: N- [(2E)- 3- (3- acetylphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)/N=C\1/SC2C(N1c1cccc(c1)C(=O)C)CS(=O)(=O)C2

STK588028
Synonyms: N- [4- ({(1E)- 1- [4- hydroxy- 1- (4- methoxyphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]ethyl}amino)phenyl]acetamide
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C(\Nc2ccc(cc2)NC(=O)C)/C)/C1=O)O

STK588029
Synonyms: N- [4- (4- chlorophenyl)- 6- methyl- 5- oxo- 2- phenyl- 2,5- dihydropyridazin- 3- yl]- 2- methylbenzamide
Smiles: Clc1ccc(cc1)c1c(=O)c(C)nn(c1NC(=O)c1ccccc1C)c1ccccc1

STK588030
Synonyms: 7- bromo- 2- (4- methylpyridin- 2- yl)- 1- [4- (propan- 2- yl)phenyl]- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1ccnc(c1)N1C(=O)c2c(C1c1ccc(cc1)C(C)C)c(=O)c1c(o2)ccc(c1)Br

STK588031
Synonyms: 3- [(3a'S,6a'R)- 5'- butyl- 7- ethyl- 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: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1cccc2CC

STK588032
Synonyms: 2- {[2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)butanoyl]amino}benzamide
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)Nc1ccccc1C(=O)N

STK588034
Synonyms: 2- {[5- (2- fluorophenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C)nnc1c1ccccc1F

STK588035
Synonyms: (5s,7s)- 5- ethyl- 2- (4- ethylphenyl)- 7- methyl- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: CCc1ccc(cc1)C1N2C[C@@]3(CN1C[C@](C2)(C3=O)CC)C

STK588036
Synonyms: (5Z)- 6- hydroxy- 5- [(2E)- 1- hydroxy- 3- (3- hydroxy- 4- methoxyphenyl)prop- 2- en- 1- ylidene]- 3- (2- methoxyphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1O)/C=C/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1OC)O)/O

STK588038
Synonyms: 6- benzyl- 2,5- dimethyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Cc1nn2c(n1)nc(c(c2O)Cc1ccccc1)C

STK588039
Synonyms: methylN- [(1- {N- [(4- methylphenyl)sulfonyl]- L- alanyl}piperidin- 4- yl)carbonyl]- L- phenylalaninate
Smiles: COC(=O)[C@H](Cc1ccccc1)NC(=O)C1CCN(CC1)C(=O)[C@@H](NS(=O)(=O)c1ccc(cc1)C)C

STK588040
Synonyms: methyl2- [(3a'S,6a'R)- 5- fluoro- 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]benzoate
Smiles: COC(=O)c1ccccc1N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cc(F)cc2

STK588041
Synonyms: 2- {[2- (4- methoxyphenyl)- 7,7- dimethyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}- N- (2- methylphenyl)acetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)Nc2ccccc2C)c2c(n1)CC(OC2)(C)C

STK588042
Synonyms: (5Z)- 5- [5- (3,4- dimethoxyphenyl)- 1- phenylpyrazolidin- 3- ylidene]- 6- hydroxy- 3- (2- phenylethyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1OC)C1C/C(=C/2\C(=NC(=O)N(C2=O)CCc2ccccc2)O)/NN1c1ccccc1

STK588043
Synonyms: 1- (furan- 2- yl)- 2- (6- methyl- 1,3- benzothiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccco1)c(=O)c1c(o2)cccc1

STK588044
Synonyms: N- cyclooctyl- 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]hexanamide
Smiles: O=C(NC1CCCCCCC1)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK588046
Synonyms: N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (pyridin- 3- ylmethyl)thiophene- 2- carboxamide
Smiles: O=C(N(Cc1cc2cccc(c2[nH]c1=O)C)Cc1cccnc1)c1cccs1

STK588048
Synonyms: (4E)- 5- (4- tert- butylphenyl)- 4- (hydroxy{4- [(3- methylbenzyl)oxy]phenyl}methylidene)- 1- (1,3- thiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: Cc1cccc(c1)COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)c1nccs1)/O

STK588050
Synonyms: 3- (4- chlorobenzyl)- 8- (2- methoxyphenyl)- 1- methyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: COc1ccccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)Cl

STK588051
Synonyms: N- (4- ethylphenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK588052
Synonyms: 9- (5- methyl- 1,2- oxazol- 3- yl)- 8- (4- nitrophenyl)- 8,9- dihydrobenzo[7,8]chromeno[2,3- c]pyrrole- 7,10- dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccc(cc1)[N+](=O)[O-])c(=O)c1c(o2)c2ccccc2cc1

STK588053
Synonyms: (4E)- 4- (dibenzo[b,d]furan- 2- ylmethylidene)- 2- (furan- 2- yl)- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C/c1ccc2c(c1)c1ccccc1o2)c1ccco1

STK588054
Synonyms: 2- (4- ethoxy- 3- methoxyphenyl)- 4- imino- 6,7,11,12- tetrahydro- 4H,10H- [1,4]dioxepino[2,3- g]pyrido[2,1- a]isoquinoline- 3- carbonitrile
Smiles: CCOc1ccc(cc1OC)c1cc2c3cc4OCCCOc4cc3CCn2c(=N)c1C#N

STK588056
Synonyms: 7- fluoro- 1- (3- hydroxyphenyl)- 2- [6- (propan- 2- yl)- 1,3- benzothiazol- 2- yl]- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Oc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)C(C)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK588059
Synonyms: N- [4- (dimethylamino)phenyl]- 2- {[4- ethyl- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)c1nnc(n1CC)SCC(=O)Nc1ccc(cc1)N(C)C

STK588061
Synonyms: 1,3- dimethyl- 8- [(4- methylpiperazin- 1- yl)methyl]- 7- (naphthalen- 1- ylmethyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CN1CCN(CC1)Cc1nc2c(n1Cc1cccc3c1cccc3)c(=O)n(c(=O)n2C)C

STK588062
Synonyms: (2E)- 1- (6- bromo- 2- hydroxy- 4- phenylquinolin- 3- yl)- 3- (2- chloro- 7- methylquinolin- 3- yl)prop- 2- en- 1- one
Smiles: Cc1ccc2c(c1)nc(c(c2)/C=C/C(=O)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Br)Cl

STK588063
Synonyms: 6- chloro- 4- ethyl- 9- [3- (morpholin- 4- yl)propyl]- 9,10- dihydro- 2H,8H- chromeno[8,7- e][1,3]oxazin- 2- one
Smiles: CCc1cc(=O)oc2c1cc(Cl)c1c2CN(CO1)CCCN1CCOCC1

STK588064
Synonyms: 2- ({4- amino- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- 1- (4- chlorophenyl)ethanone
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)c1ccc(cc1)Cl

STK588065
Synonyms: (6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)(3- fluorophenyl)methanone
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=O)c1cccc(c1)F

STK588066
Synonyms: N- (2,6- diethylphenyl)- 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)acetamide
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)Nc1c(CC)cccc1CC

STK588067
Synonyms: 3- (1H- benzimidazol- 2- yl)- N- (3- phenylpropyl)propanamide
Smiles: O=C(CCc1nc2c([nH]1)cccc2)NCCCc1ccccc1

STK588068
Synonyms: 1- (2- methoxyphenyl)- 2- [3- (morpholin- 4- yl)propyl]- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccccc1C1N(CCCN2CCOCC2)C(=O)c2c1c(=O)c1c(o2)cccc1

STK588070
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- chlorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- fluoro- 4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)F)C)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK588072
Synonyms: 7,7- dimethyl- 2- phenyl- 4- (propan- 2- ylsulfanyl)- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidine
Smiles: CC(Sc1nc(nc2c1COC(C2)(C)C)c1ccccc1)C

STK588073
Synonyms: 7- [(2,6- dichlorobenzyl)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: Clc1cccc(c1CSc1nnc2n1c1sc3c(c1c1n2ncn1)CC(OC3)(C)C)Cl

STK588075
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 2- (9- methoxy- 5- oxo- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 6(5H)- yl)acetamide
Smiles: COc1ccc2c(c1)c1nc3SCCn3c(=O)c1n2CC(=O)NCCc1ccc(c(c1)OC)OC

STK588078
Synonyms: 3- (7- methyl- 3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)- 1- [3- (trifluoromethyl)phenyl]pyrrolidine- 2,5- dione
Smiles: CC1N(CCc2c1cc1OCCCOc1c2)C1CC(=O)N(C1=O)c1cccc(c1)C(F)(F)F

STK588080
Synonyms: (2'S,3S,3'S,10b'R)- 3'- (1,3- benzodioxol- 5- ylcarbonyl)- 2'- {[3- (prop- 2- en- 1- yloxy)phenyl]carbonyl}- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: C=CCOc1cccc(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc3c(c2)OCO3)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK588081
Synonyms: 2- [(2- oxo- 2H- chromen- 7- yl)oxy]- N- (4- phenoxyphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Oc1ccccc1)COc1ccc2c(c1)oc(=O)cc2

STK588082
Synonyms: cyclohexyl[4- (dimethylamino)phenyl][hydroxy(2- methoxyphenyl)methyl]phosphinate
Smiles: COc1ccccc1C(P(=O)(c1ccc(cc1)N(C)C)OC1CCCCC1)O

STK588084
Synonyms: N- {[3- (trifluoromethyl)phenyl]carbamoyl}- L- methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)Nc1cccc(c1)C(F)(F)F

STK588091
Synonyms: methylN- {[2- (cyclohex- 1- en- 1- yl)ethyl]carbamoyl}- L- methioninate
Smiles: CSCC[C@@H](C(=O)OC)NC(=O)NCCC1=CCCCC1

STK588092
Synonyms: (4E)- 2- (5- bromopyridin- 2- yl)- 4- {[(2- methylphenyl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: Brc1ccc(nc1)N1C(=O)/C(=C/Nc2ccccc2C)/c2c(C1=O)cccc2

STK588094
Synonyms: N- [4- (benzyloxy)phenyl]- 2- {[4- (furan- 2- ylmethyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C

STK588095
Synonyms: 2- ({4- amino- 5- [5- (4- methylphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,5- dimethylphenyl)acetamide
Smiles: O=C(Nc1cc(C)ccc1C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK588096
Synonyms: (4E)- 1- {5- [(2- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 5- (3- hydroxyphenyl)pyrrolidine- 2,3- dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)O)c1nnc(s1)SCc1ccccc1Cl)/O

STK588099
Synonyms: 2- (2,4- dichlorophenyl)- 10- methyl- 8,11- diphenyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Clc1ccc(c(c1)Cl)c1nn2c(n1)c1c(nc2)Oc2c(C1c1ccccc1)c(C)nn2c1ccccc1

STK588101
Synonyms: N- (2- chloro- 4- methylphenyl)- 1- ({1- [(4- methylphenyl)sulfonyl]piperidin- 4- yl}carbonyl)- L- prolinamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1CCC[C@H]1C(=O)Nc1ccc(cc1Cl)C

STK588104
Synonyms: ethyl1- (2- phenyl[1]benzofuro[3,2- d]pyrimidin- 4- yl)piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)c1nc(nc2c1oc1c2cccc1)c1ccccc1

STK588105
Synonyms: N- (2- bromophenyl)- 2- {[4- (4- methylphenyl)- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1Br)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1

STK588106
Synonyms: 2- {[4,5- bis(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

STK588107
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- (3- ethoxyphenyl)- 1- (5- methyl- 1,3,4- thiadiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)C

STK588110
Synonyms: (5Z)- 3- (2- chlorophenyl)- 6- hydroxy- 5- [(2E)- 1- hydroxy- 3- (3- hydroxy- 4- methoxyphenyl)prop- 2- en- 1- ylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1O)/C=C/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1Cl)O)/O

STK588112
Synonyms: 2- tert- butyl- 7- (5- chloro- 2- methylphenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Clc1ccc(c(c1)n1ncc2c1ncn1c2nc(n1)C(C)(C)C)C

STK588113
Synonyms: N- [(2E)- 3- (3- methoxyphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 4- phenylbutanamide
Smiles: COc1cccc(c1)N1/C(=N\C(=O)CCCc2ccccc2)/SC2C1CS(=O)(=O)C2

STK588114
Synonyms: 9- methyl- 3- [(Z)- (4- oxo- 3- propyl- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 2- (4- phenylpiperazin- 1- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccccc2)/C1=O

STK588115
Synonyms: 3- [(4- tert- butylbenzyl)sulfanyl]- 4- (4- methoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazole
Smiles: COc1ccc(cc1)n1c(nnc1COc1ccc(cc1)C)SCc1ccc(cc1)C(C)(C)C

STK588117
Synonyms: 3- amino- 6- (pyridin- 4- yl)- N- [3- (trifluoromethyl)phenyl]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)ccc(n2)c1ccncc1)Nc1cccc(c1)C(F)(F)F

STK588118
Synonyms: 1',3'- diethyl- 3- (2- fluorophenyl)- 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)Cc1ccccc1N1C2CN(CC1)c1ccccc1F

STK588119
Synonyms: 8- (5- chloro- 2- methoxyphenyl)- 1,7- dimethyl- 3- (2- methylprop- 2- en- 1- yl)- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COc1ccc(cc1n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CC(=C)C)Cl

STK588120
Synonyms: 2- (6- methoxy- 1,3- benzothiazol- 2- yl)- 1- (4- nitrophenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccc(cc1)[N+](=O)[O-])c(=O)c1c(o2)cccc1

STK588121
Synonyms: 14- (2- bromophenyl)- 3,3- dimethyl- 2,3,4,6,7,14- hexahydro- 1H- [1,3]dioxolo[6,7]isoquino[2,1- a]quinolin- 1- one
Smiles: O=C1CC(C)(C)CC2=C1C(C=C1N2CCc2c1cc1c(c2)OCO1)c1ccccc1Br

STK588124
Synonyms: 4- {[(E)- (2- chloro- 6- fluorophenyl)methylidene]amino}- 5- (2- methylphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1ccccc1c1n[nH]c(=S)n1/N=C/c1c(F)cccc1Cl

STK588125
Synonyms: N- [4- (diethylamino)phenyl]- 4,5,6- trimethoxy- 1H- indole- 2- carboxamide
Smiles: CCN(c1ccc(cc1)NC(=O)c1cc2c([nH]1)cc(c(c2OC)OC)OC)CC

STK588128
Synonyms: 3,5- dimethoxy- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (2- methylpropyl)benzamide
Smiles: COc1cc(OC)cc(c1)C(=O)N(Cc1cc2cc(C)ccc2[nH]c1=O)CC(C)C

STK588129
Synonyms: N- [(2Z)- 3- (2,4- dimethylphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]butanamide
Smiles: CCCC(=O)/N=C/1\SC2C(N1c1ccc(cc1C)C)CS(=O)(=O)C2

STK588130
Synonyms: N- [(3Z)- 1- butyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 4- chlorobenzenesulfonamide
Smiles: CCCCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)Cl)/c2c1nc1ccccc1c2

STK588131
Synonyms: 2- methoxy- 6- {4- [5- methyl- 2- (propan- 2- yl)phenoxy]quinazolin- 2- yl}phenol
Smiles: COc1cccc(c1O)c1nc(Oc2cc(C)ccc2C(C)C)c2c(n1)cccc2

STK588132
Synonyms: N- [3- (4- methoxyphenyl)- 1- methyl- 4- oxo- 1,4- dihydroquinolin- 2- yl]butanamide
Smiles: CCCC(=O)Nc1c(c2ccc(cc2)OC)c(=O)c2c(n1C)cccc2

STK588135
Synonyms: 6- hydroxy- 5- [(2E)- 3- (4- hydroxy- 3- methoxy- 5- nitrophenyl)prop- 2- enoyl]- 1,3- dimethylpyrimidine- 2,4(1H,3H)- dione
Smiles: COc1cc(/C=C/C(=O)c2c(O)n(C)c(=O)n(c2=O)C)cc(c1O)[N+](=O)[O-]

STK588136
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- (4- methoxyphenyl)- 1- {5- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK588137
Synonyms: 2- (9- fluoro- 5- oxo- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 6(5H)- yl)- N- (2- phenylethyl)acetamide
Smiles: O=C(Cn1c2ccc(cc2c2c1c(=O)n1CCSc1n2)F)NCCc1ccccc1

STK588140
Synonyms: 4- (butylsulfanyl)- 7,7- dimethyl- 2- phenyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidine
Smiles: CCCCSc1nc(nc2c1COC(C2)(C)C)c1ccccc1

STK588141
Synonyms: 2- methoxy- N- (2- methoxyethyl)- N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]acetamide
Smiles: COCCN(C(=O)COC)Cc1cc2cccc(c2[nH]c1=O)C

STK588142
Synonyms: N- cyclohexyl- 5,10,10- trimethyl- 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)NC1CCCCC1

STK588143
Synonyms: N- {[1- (tert- butoxycarbonyl)piperidin- 4- yl]carbonyl}- L- valine
Smiles: CC([C@@H](C(=O)O)NC(=O)C1CCN(CC1)C(=O)OC(C)(C)C)C

STK588144
Synonyms: 3- (thiophen- 2- yl)- 3,4- dihydro- 2H- dibenzo[b,e][1,4]diazepin- 1- ol
Smiles: OC1=C2C=Nc3c(N=C2CC(C1)c1cccs1)cccc3

STK588145
Synonyms: N- [(2E)- 3- (4- fluorobenzyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- phenylacetamide
Smiles: O=C(/N=C\1/SC2C(N1Cc1ccc(cc1)F)CS(=O)(=O)C2)Cc1ccccc1

STK588147
Synonyms: methyl4- oxo- 2- sulfanyl- 3- (2,2,6,6- tetramethylpiperidin- 4- yl)- 3,4- dihydroquinazoline- 7- carboxylate
Smiles: COC(=O)c1ccc2c(c1)nc(n(c2=O)C1CC(C)(C)NC(C1)(C)C)S

STK588148
Synonyms: 6- cyclohexyl- 2- hydroxy- 1- (2- phenylethyl)- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(O)n(c2c1CN(CN2)C1CCCCC1)CCc1ccccc1

STK588149
Synonyms: 1- benzyl4- (4- methyl- 2- oxo- 2H- chromen- 7- yl)piperidine- 1,4- dicarboxylate
Smiles: O=C(C1CCN(CC1)C(=O)OCc1ccccc1)Oc1ccc2c(c1)oc(=O)cc2C

STK588150
Synonyms: 2- phenyl- 5,6,10,11- tetrahydro- 9H- [1,4]dioxepino[2,3- g]pyrrolo[2,1- a]isoquinoline
Smiles: C1COc2c(OC1)cc1c(c2)c2cc(cn2CC1)c1ccccc1

STK588152
Synonyms: 8- (3- chlorophenyl)- 1- methyl- 3- (4- methylbenzyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: Cc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1cccc(c1)Cl

STK588154
Synonyms: N- [(1Z)- 1- {1- cyano- 2- [(3- methylphenyl)amino]- 2- oxoethylidene}- 1H- isoindol- 3- yl]benzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccccc1)/C(=O)Nc1cccc(c1)C

STK588156
Synonyms: 5- (1,3- benzodioxol- 5- ylmethyl)- N- [(2E)- 4,6,7- trimethylquinazolin- 2(1H)- ylidene]- 1,4,5,6- tetrahydro- 1,3,5- triazin- 2- amine
Smiles: Cc1cc2c(C)n/c(=N/C3=NCN(CN3)Cc3ccc4c(c3)OCO4)/[nH]c2cc1C

STK588157
Synonyms: 1- ({1,3- dimethyl- 7- [2- (morpholin- 4- yl)ethyl]- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl}methyl)piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)Cc1nc2c(n1CCN1CCOCC1)c(=O)n(c(=O)n2C)C

STK588158
Synonyms: 7- (3- hydroxypropyl)- 1,3- dimethyl- 8- [(3- methylpiperidin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCCCn1c(CN2CCCC(C2)C)nc2c1c(=O)n(c(=O)n2C)C

STK588159
Synonyms: (4E)- 4- [(4- ethoxyphenyl)(hydroxy)methylidene]- 1- (4- methoxyphenyl)- 5- (3- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: CCOc1ccc(cc1)/C(=C\1/C(c2cccc(c2)[N+](=O)[O-])N(C(=O)C1=O)c1ccc(cc1)OC)/O

STK588160
Synonyms: 5- [3- (benzyloxy)phenyl]- N'- [(E)- (3,5- dimethyl- 1- phenyl- 1H- pyrazol- 4- yl)methylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1cccc(c1)OCc1ccccc1)N/N=C/c1c(C)nn(c1C)c1ccccc1

STK588161
Synonyms: (3a'S,6a'R)- 5- bromo- 5'- (butan- 2- yl)- 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: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cc(Br)cc2)C

STK588163
Synonyms: N- [(2E)- 6- methoxy- 4- methylquinazolin- 2(1H)- ylidene]- 5- (pyridin- 3- ylmethyl)- 1,4,5,6- tetrahydro- 1,3,5- triazin- 2- amine
Smiles: COc1ccc2c(c1)c(C)n/c(=N/C1=NCN(CN1)Cc1cccnc1)/[nH]2

STK588164
Synonyms: N- benzyl- N- ethyl- 4,5,6,7- tetrahydro- 2H- indazole- 3- carboxamide
Smiles: CCN(C(=O)c1[nH]nc2c1CCCC2)Cc1ccccc1

STK588166
Synonyms: 3- (4- methylphenyl)- 3,4- dihydro- 2H- dibenzo[b,e][1,4]diazepin- 1- ol
Smiles: Cc1ccc(cc1)C1CC(=C2C(=Nc3ccccc3N=C2)C1)O

STK588167
Synonyms: 3- (3- chlorophenyl)- 12- (pyridin- 3- yl)- 2,3,4,12- tetrahydrobenzimidazo[2,1- b]quinazolin- 1- ol
Smiles: Clc1cccc(c1)C1CC(=C2C(=Nc3n(C2c2cccnc2)c2c(n3)cccc2)C1)O

STK588172
Synonyms: (4E)- 4- [(4- chlorophenyl)(hydroxy)methylidene]- 5- (4- ethoxy- 3- methoxyphenyl)- 1- (5- methyl- 1,2- oxazol- 3- yl)pyrrolidine- 2,3- dione
Smiles: CCOc1ccc(cc1OC)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1c1noc(c1)C

STK588174
Synonyms: N- [4- (diethylamino)phenyl]- 2- {[4- (4- ethoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)N(CC)CC)nnc1COc1ccccc1

STK588175
Synonyms: 2- {benzyl[2,2- dimethyl- 5- (propan- 2- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8- yl]amino}ethanol
Smiles: OCCN(c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C(C)C)Cc1ccccc1

STK588176
Synonyms: 4- acetyl- N- [(3Z)- 1- butyl- 8- methyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]benzenesulfonamide
Smiles: CCCCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)C(=O)C)/c2c1nc1c(C)cccc1c2

STK588180
Synonyms: 6- (4- methoxybenzyl)- 1- (2- methylphenyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: COc1ccc(cc1)CN1CNc2c(C1)c(=O)nc(n2c1ccccc1C)S

STK588181
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- (5- oxo- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 6(5H)- yl)acetamide
Smiles: O=C(Cn1c2ccccc2c2c1c(=O)n1CCSc1n2)Nc1ccc2c(c1)OCO2

STK588182
Synonyms: (5Z)- 5- [1- acetyl- 5- (3,4- dimethoxyphenyl)pyrazolidin- 3- ylidene]- 1- (prop- 2- en- 1- yl)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: C=CCN1C(=O)NC(=O)/C(=C/2\CC(N(N2)C(=O)C)c2ccc(c(c2)OC)OC)/C1=O

STK588185
Synonyms: 3- cyclopentyl- N- [(2Z)- 5,5- dioxido- 3- phenyltetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]propanamide
Smiles: O=C(/N=C/1\SC2C(N1c1ccccc1)CS(=O)(=O)C2)CCC1CCCC1

STK588187
Synonyms: N- (2,5- dichlorophenyl)- 2- {[4- (4- methylphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)ccc1Cl)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1

STK588188
Synonyms: 2- [(2- hydroxyethyl)amino]- 3- phenyl- 3,5,6,7,8,9- hexahydro- 4H- cyclohepta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: OCCNc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCCC3

STK588189
Synonyms: 2- (2,3- dimethylbutan- 2- yl)- 4- methylphenylphenylcarbamate
Smiles: O=C(Oc1ccc(cc1C(C(C)C)(C)C)C)Nc1ccccc1

STK588190
Synonyms: 2- amino- 6- phenyl- 4- (3,4,5- trimethoxyphenyl)pyridine- 3- carbonitrile
Smiles: N#Cc1c(N)nc(cc1c1cc(OC)c(c(c1)OC)OC)c1ccccc1

STK588191
Synonyms: tert- butyl(3S)- 3- ({(2S)- 1- [(4- methoxybenzyl)amino]- 3- methyl- 1- oxobutan- 2- yl}carbamoyl)- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: COc1ccc(cc1)CNC(=O)[C@H](C(C)C)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK588193
Synonyms: 2- (4- benzylpiperazin- 1- yl)- N- [(2Z)- 4- phenyl- 1,3- thiazol- 2(3H)- ylidene]acetamide
Smiles: O=C(/N=c/1\scc([nH]1)c1ccccc1)CN1CCN(CC1)Cc1ccccc1

STK588198
Synonyms: N- (furan- 2- ylmethyl)- N- (4- methoxybenzyl)- 2- oxo- 2,3- dihydro- 1,3- benzoxazole- 6- sulfonamide
Smiles: COc1ccc(cc1)CN(S(=O)(=O)c1ccc2c(c1)oc(=O)[nH]2)Cc1ccco1

STK588201
Synonyms: 5- (3- ethoxyphenyl)- 4- ({(E)- [4- (pentyloxy)phenyl]methylidene}amino)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCCCCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)OCC

STK588202
Synonyms: (2E)- 3- (2- methoxyphenyl)- N- [(4- phenyltetrahydro- 2H- pyran- 4- yl)methyl]prop- 2- enamide
Smiles: COc1ccccc1/C=C/C(=O)NCC1(CCOCC1)c1ccccc1

STK588203
Synonyms: 5- {[(2Z)- 3- (4- bromo- 2,6- dimethylphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]amino}- 5- oxopentanoicacid
Smiles: OC(=O)CCCC(=O)/N=C/1\SC2C(N1c1c(C)cc(cc1C)Br)CS(=O)(=O)C2

STK588204
Synonyms: 8- {[4- (furan- 2- ylcarbonyl)piperazin- 1- yl]methyl}- 7- heptyl- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(CN2CCN(CC2)C(=O)c2ccco2)nc2c1c(=O)n(c(=O)n2C)C

STK588205
Synonyms: 5,9- dimethyl- 2- (pyridin- 3- yl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CC1CCc2c(C1)sc1c2c2nc(nn2c(n1)C)c1cccnc1

STK588206
Synonyms: N- {4- [(3a'S,6a'R)- 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)Nc2c1cccc2

STK588207
Synonyms: 4- (2,3- dimethylbutan- 2- yl)phenylphenylcarbamate
Smiles: O=C(Nc1ccccc1)Oc1ccc(cc1)C(C(C)C)(C)C

STK588208
Synonyms: 2- (benzylsulfanyl)- 9- (3- hydroxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Oc1cccc(c1)C1C2=C(O)CCCC2=Nc2n1nc(n2)SCc1ccccc1

STK588210
Synonyms: 2- [5- hydroxy- 2- (4- methylphenyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]hexahydro- 1H- isoindole- 1,3(2H)- dione
Smiles: Cc1ccc(cc1)c1nn2c(n1)nc(cc2N1C(=O)C2C(C1=O)CCCC2)O

STK588211
Synonyms: (1'S,3R,3'S,7a'S)- 7''- chloro- 1'- [(2- ethoxyphenyl)carbonyl]- 5',6',7',7a'- tetrahydro- 1'H- dispiro[indole- 3,2'- pyrrolizine- 3',3''- indole]- 2,2''(1H,1''H)- dione
Smiles: CCOc1ccccc1C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cccc1Cl

STK588213
Synonyms: 2- (4- fluorophenyl)- 3- (2- methoxyethyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1ccc(cc1)F

STK588214
Synonyms: 8- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 7- (2- methylbenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1Cc1ccccc1C)c(=O)n(c(=O)n2C)C

STK588216
Synonyms: 9- (4- chlorobenzyl)- 6- methyl- 2,3,9,10- tetrahydro- 8H- cyclopenta[3,4]chromeno[6,7- e][1,3]oxazin- 4(1H)- one
Smiles: Clc1ccc(cc1)CN1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCC2

STK588217
Synonyms: N- (furan- 2- ylmethyl)- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]pyridine- 4- carboxamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(C(=O)c1ccncc1)Cc1ccco1

STK588218
Synonyms: [(3aR,4R,4aR,7aS,8R,8aR)- 3- (3- nitrophenyl)- 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: OC(=O)CN1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1C[C@H]2[C@H]2[C@@H]1ON=C2c1cccc(c1)[N+](=O)[O-]

STK588219
Synonyms: 2- hydroxy- N'- [(E)- quinolin- 6- ylmethylidene]benzohydrazide
Smiles: O=C(c1ccccc1O)N/N=C/c1ccc2c(c1)cccn2

STK588223
Synonyms: 5- (4- chlorophenyl)- 10- (4- hydroxyphenyl)- 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: Oc1ccc(cc1)C1OCC(n2c1c1n(C)c(=O)n(c(=O)c1c2c1ccc(cc1)Cl)C)(C)C

STK588224
Synonyms: 5- (3,4,5- trimethoxyphenyl)- 4- {[(E)- (2,4,6- trimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(OC)c(c(c1)OC)/C=N/n1c(=S)[nH]nc1c1cc(OC)c(c(c1)OC)OC

STK588227
Synonyms: 8- (3- chloro- 2- methylphenyl)- 3- ethyl- 1- methyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1cccc(c1C)Cl

STK588228
Synonyms: 3- (3- chlorophenyl)- 4- (4- chlorophenyl)- 5- [(3- fluorobenzyl)sulfanyl]- 4H- 1,2,4- triazole
Smiles: Clc1ccc(cc1)n1c(SCc2cccc(c2)F)nnc1c1cccc(c1)Cl

STK588229
Synonyms: N- (2,5- dimethylphenyl)- 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]hexanamide
Smiles: O=C(Nc1cc(C)ccc1C)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK588230
Synonyms: (3a'S,6a'R)- 5- bromo- 5'- butyl- 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)CCCC)C(=O)Nc1c2cc(Br)cc1

STK588231
Synonyms: 7- (3- chlorobenzyl)- 8- [(2- hydroxyethyl)(methyl)amino]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCCN(c1nc2c(n1Cc1cccc(c1)Cl)c(=O)n(c(=O)n2C)C)C

STK588232
Synonyms: 2- [(2,5- dichlorophenyl)sulfonyl]- 6,7- dimethoxy- 1- methyl- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1cc2c(cc1OC)CCN(C2C)S(=O)(=O)c1cc(Cl)ccc1Cl

STK588233
Synonyms: methylN- [(4- phenoxyphenyl)carbamoyl]- D- phenylalaninate
Smiles: COC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccc(cc1)Oc1ccccc1

STK588235
Synonyms: (3R,3'S,3a'S,6a'R)- 5'- (2- bromophenyl)- 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)c1ccccc1Br)C(=O)Nc1c2cccc1

STK588239
Synonyms: 9- (4- ethoxyphenyl)- 3- hexyl- 1- methyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: CCCCCCn1c(=O)c2n3CCCN(c3nc2n(c1=O)C)c1ccc(cc1)OCC

STK588240
Synonyms: propyl[4- (dimethylamino)phenyl][hydroxy(pyridin- 4- yl)methyl]phosphinate
Smiles: CCCOP(=O)(C(c1ccncc1)O)c1ccc(cc1)N(C)C

STK588242
Synonyms: 2- (6- ethyl- 1,3- benzothiazol- 2- yl)- 1- (3- hydroxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccc(c1)O)c(=O)c1c(o2)cccc1

STK588243
Synonyms: (1'S,3R,3'S,7a'S)- 1'- [(4- fluorophenyl)carbonyl]- 5''- methyl- 5',6',7',7a'- tetrahydro- 1'H- dispiro[indole- 3,2'- pyrrolizine- 3',3''- indole]- 2,2''(1H,1''H)- dione
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(C)cc1

STK588244
Synonyms: N- [(2Z)- 3- (2,4- dimethoxyphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- methoxyacetamide
Smiles: COCC(=O)/N=C/1\SC2C(N1c1ccc(cc1OC)OC)CS(=O)(=O)C2

STK588247
Synonyms: 1'- butyl- 2'- hydroxy- 13- methyl- 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: CCCCN1C(=NC(=O)C2(C1=O)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2C)O

STK588248
Synonyms: N- [(2Z)- 3- (3,4- dimethoxybenzyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]tetrahydrofuran- 2- carboxamide
Smiles: COc1cc(ccc1OC)CN1/C(=N/C(=O)C2CCCO2)/SC2C1CS(=O)(=O)C2

STK588249
Synonyms: N- (3- fluorophenyl)- 5- (phenoxymethyl)furan- 2- carboxamide
Smiles: Fc1cccc(c1)NC(=O)c1ccc(o1)COc1ccccc1

STK588250
Synonyms: 5- (2- fluorophenyl)- 4- {[(E)- (4- methylphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccc1F

STK588251
Synonyms: 3- amino- 6- (1,3- benzodioxol- 5- yl)- N- (2,4- dichlorophenyl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: Clc1ccc(c(c1)Cl)NC(=O)c1sc2c(c1N)ccc(n2)c1ccc2c(c1)OCO2

STK588252
Synonyms: 2- [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]phenol
Smiles: COc1ccc(cc1)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1ccccc1O)c1cccc(c1)Cl

STK588253
Synonyms: 2- (4- fluorophenyl)- 10- 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: Fc1ccc(cc1)c1nn2c(n1)c1c(nc2)Oc2c(C1c1cccnc1)c(C)nn2c1ccccc1

STK588254
Synonyms: 4- {(Z)- [2- (3- bromophenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}- 2- methoxyphenylethylcarbonate
Smiles: CCOC(=O)Oc1ccc(cc1OC)/C=C/1\N=C(OC1=O)c1cccc(c1)Br

STK588255
Synonyms: 8- (4- ethoxyphenyl)- 1- methyl- 3- (2- methylpropyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CC(C)C

STK588257
Synonyms: 4- {[(E)- (5- bromothiophen- 2- yl)methylidene]amino}- 5- (4- methylphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(s1)Br

STK588258
Synonyms: 5- [2- (benzyloxy)phenyl]- N'- [(E)- thiophen- 2- ylmethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccccc1OCc1ccccc1)N/N=C/c1cccs1

STK588260
Synonyms: N- [4- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- ylsulfonyl)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1

STK588262
Synonyms: N- (3,5- dichlorophenyl)- 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)acetamide
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)Nc1cc(Cl)cc(c1)Cl

STK588263
Synonyms: N- {2- [(4- fluorophenyl)carbonyl]- 1- benzofuran- 3- yl}- 5- (2- hydroxy- 3,4- dimethylphenyl)- 1H- pyrazole- 3- carboxamide
Smiles: Fc1ccc(cc1)C(=O)c1oc2c(c1NC(=O)c1n[nH]c(c1)c1ccc(c(c1O)C)C)cccc2

STK588264
Synonyms: 3- (furan- 2- ylmethyl)- 2- {[3- (morpholin- 4- yl)propyl]amino}- 3,5,6,7,8,9- hexahydro- 4H- cyclohepta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: O=c1c2c(sc3c2CCCCC3)nc(n1Cc1ccco1)NCCCN1CCOCC1

STK588265
Synonyms: N- (2- {2- amino- 3- [(4- methylphenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 1- yl}ethyl)- 4- methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)NCCn1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccc(cc1)C

STK588266
Synonyms: N- [4- (benzyloxy)phenyl]- 2- {[4- (4- chlorophenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK588270
Synonyms: 2- methyl- 9- [4- (2- methylphenyl)piperazin- 1- yl]- 3- phenyl- 5,6,7,8- tetrahydropyrazolo[5,1- b]quinazoline
Smiles: Cc1ccccc1N1CCN(CC1)c1c2CCCCc2nc2n1nc(c2c1ccccc1)C

STK588272
Synonyms: N- [4- ({(1E)- 1- [1- (4- chlorophenyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]propyl}amino)phenyl]acetamide
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)/Nc1ccc(cc1)NC(=O)C

STK588275
Synonyms: methylN- [(4- methoxy- 1H- indol- 2- yl)carbonyl]glycinate
Smiles: COC(=O)CNC(=O)c1[nH]c2c(c1)c(OC)ccc2

STK588276
Synonyms: 1- (3- ethoxyphenyl)- 2- (prop- 2- en- 1- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: C=CCN1C(=O)c2c(C1c1cccc(c1)OCC)c(=O)c1c(o2)cccc1

STK588277
Synonyms: 3- [2- (4- methoxyphenyl)ethyl]- 2,10- dimethylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: COc1ccc(cc1)CCn1c(C)nc2c(c1=O)c(=O)c1c(n2C)cccc1

STK588279
Synonyms: 2- (6- chloro- 1,3- benzothiazol- 2- yl)- 1- (3,4- dimethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cc(ccc1OC)C1N(c2nc3c(s2)cc(cc3)Cl)C(=O)c2c1c(=O)c1c(o2)cccc1

STK588280
Synonyms: 3- (1H- benzimidazol- 2- yl)- N- [(1- ethylpyrrolidin- 2- yl)methyl]propanamide
Smiles: CCN1CCCC1CNC(=O)CCc1nc2c([nH]1)cccc2

STK588282
Synonyms: 2,2- dimethyl- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (4- methylphenyl)propanamide
Smiles: Cc1ccc(cc1)N(C(=O)C(C)(C)C)Cc1cc2cc(C)ccc2[nH]c1=O

STK588284
Synonyms: 8- {[4- (diphenylmethyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK588285
Synonyms: 4- chloro- N- [4- oxo- 3- (3,4,5- trimethoxyphenyl)- 4H- chromen- 2- yl]benzamide
Smiles: COc1cc(cc(c1OC)OC)c1c(NC(=O)c2ccc(cc2)Cl)oc2c(c1=O)cccc2

STK588289
Synonyms: 4- ({(E)- [4- (benzyloxy)- 3- methoxyphenyl]methylidene}amino)- 5- (2- methoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(ccc1OCc1ccccc1)/C=N/n1c(=S)[nH]nc1c1ccccc1OC

STK588291
Synonyms: 2- ({4- (furan- 2- ylmethyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3- methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK588292
Synonyms: 4- ({(2'S,3S,3'S,10b'R)- 2- oxo- 2'- [(4- propylphenyl)carbonyl]- 1,2,2',3'- tetrahydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 3'- yl}carbonyl)phenylacetate
Smiles: CCCc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)OC(=O)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK588293
Synonyms: 4- [(E)- {[3- (2- chlorophenyl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]imino}methyl]- 2,6- dimethoxyphenylacetate
Smiles: COc1cc(/C=N/n2c(=S)[nH]nc2c2ccccc2Cl)cc(c1OC(=O)C)OC

STK588294
Synonyms: N- [(2Z)- 5,5- dioxido- 3- phenyltetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]tetrahydrofuran- 2- carboxamide
Smiles: O=C(C1CCCO1)/N=C/1\SC2C(N1c1ccccc1)CS(=O)(=O)C2

STK588295
Synonyms: 2- benzyl- 9- propyl- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CCCN1CCc2c(C1)sc1c2c2nc(nn2cn1)Cc1ccccc1

STK588298
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- (4- ethoxyphenyl)- 1- (5- methyl- 1,3,4- thiadiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)C

STK588299
Synonyms: (4Z)- 6- {[4- (3- methoxyphenyl)piperazin- 1- yl]methyl}- 4- [(3- methylphenyl)imino]- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: COc1cccc(c1)N1CCN(CC1)Cc1nc(N)n/c(=N\c2cccc(c2)C)/[nH]1

STK588301
Synonyms: 2- {[5- (3- methoxyphenyl)- 4- (4- methoxyphenyl)- 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)nnc1c1cccc(c1)OC

STK588302
Synonyms: 4- [(3- {(E)- [1- (furan- 2- ylmethyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}- 1H- indol- 1- yl)methyl]benzonitrile
Smiles: N#Cc1ccc(cc1)Cn1cc(c2c1cccc2)/C=C/1\C(=NC(=O)N(C1=O)Cc1ccco1)O

STK588303
Synonyms: (3R,3'S,5'S)- 5'- (3- amino- 3- oxopropyl)- N- (2,5- dimethoxyphenyl)- 6,7- dimethyl- 2- oxo- 1,2- dihydrospiro[indole- 3,2'- pyrrolidine]- 3'- carboxamide
Smiles: COc1ccc(cc1NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2ccc(c1C)C)CCC(=O)N)OC

STK588306
Synonyms: 2- [(3a'S,6a'R)- 6- chloro- 5'- cyclohexyl- 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]acetamide
Smiles: NC(=O)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C1CCCCC1)C(=O)Nc1c2ccc(c1C)Cl

STK588307
Synonyms: N- (4- bromophenyl)- 2- {[4- (4- ethoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Br)nnc1COc1ccccc1

STK588308
Synonyms: 3- [(4- tert- butylbenzyl)sulfanyl]- 5- (4- tert- butylphenyl)- 4- phenyl- 4H- 1,2,4- triazole
Smiles: CC(c1ccc(cc1)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)(C)C

STK588309
Synonyms: 4- {[(E)- (2,5- dimethoxyphenyl)methylidene]amino}- 5- (3- methylphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(c(c1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)C)OC

STK588310
Synonyms: 3- (4- chlorophenyl)- 6,6- dimethyl- 1- (propan- 2- yl)- 1,5,6,8- tetrahydro- 2H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine- 2,4(3H)- dione
Smiles: Clc1ccc(cc1)n1c(=O)c2c3CC(C)(C)OCc3sc2n(c1=O)C(C)C

STK588311
Synonyms: 8- {[4- (4- methoxyphenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 7- (3- oxobutan- 2- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1C(C(=O)C)C)c(=O)n(c(=O)n2C)C

STK588312
Synonyms: 2,5,9- trimethyl- 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(nn2c(n1)C)C

STK588313
Synonyms: 7- fluoro- 2- methyl- 1- (3,4,5- trimethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cc(cc(c1OC)OC)C1N(C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK588314
Synonyms: 3,4- dimethyl- 9- (tetrahydrofuran- 2- ylmethyl)- 9,10- dihydro- 2H,8H- chromeno[8,7- e][1,3]oxazin- 2- one
Smiles: O=c1oc2c3CN(COc3ccc2c(c1C)C)CC1CCCO1

STK588315
Synonyms: 1,6,7- trimethyl- 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)c2c1nc1n2c(c(n1CC1CCCO1)C)C

STK588316
Synonyms: N- (3- methoxyphenyl)- 2- ({5- [(4- methylphenoxy)methyl]- 4- phenyl- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(n1c1ccccc1)COc1ccc(cc1)C

STK588317
Synonyms: 3- {[4- (pyrrolidin- 1- ylcarbonyl)cyclohexyl]methyl}quinazolin- 4(3H)- one
Smiles: O=C(N1CCCC1)C1CCC(CC1)Cn1cnc2c(c1=O)cccc2

STK588318
Synonyms: N- (3- chloro- 4- fluorophenyl)- 2- {[4- (4- methylphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK588319
Synonyms: 3- (4- chlorophenyl)- 4- phenyl- 5- {[3- (trifluoromethyl)benzyl]sulfanyl}- 4H- 1,2,4- triazole
Smiles: Clc1ccc(cc1)c1nnc(n1c1ccccc1)SCc1cccc(c1)C(F)(F)F

STK588320
Synonyms: 8- (2,4- dimethoxyphenyl)- 1,3- dimethyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: COc1cc(OC)ccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)C

STK588321
Synonyms: 7,7- dimethyl- 2- (4- methylphenyl)- 4- (prop- 2- en- 1- ylsulfanyl)- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidine
Smiles: C=CCSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)C

STK588323
Synonyms: (2Z)- 1- (5- bromofuran- 2- yl)- 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 1(2H)- ylidene)ethanone
Smiles: COc1cc2/C(=C/C(=O)c3ccc(o3)Br)/NCCc2cc1OC

STK588324
Synonyms: 2,4- dichloro- N- [(1Z)- 1- {1- cyano- 2- [(furan- 2- ylmethyl)amino]- 2- oxoethylidene}- 1H- isoindol- 3- yl]benzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1Cl)Cl)/C(=O)NCc1ccco1

STK588325
Synonyms: 2- {[4- (4- chlorophenyl)- 3- cyano- 5- hydroxy- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- (2,5- dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cc(C)ccc2C)N=C2C(=C(O)CCC2)C1c1ccc(cc1)Cl

STK588326
Synonyms: N- (4- ethylphenyl)- 2- {[4- (4- methylphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK588328
Synonyms: N- [5- hydroxy- 2- (4- methylphenyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]- 4- methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)Nc1cc(O)nc2n1nc(n2)c1ccc(cc1)C

STK588331
Synonyms: N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (2- methylpropyl)benzamide
Smiles: CC(CN(C(=O)c1ccccc1)Cc1cc2cccc(c2[nH]c1=O)C)C

STK588333
Synonyms: 6- hydroxy- 7- [2- hydroxy- 3- (3- methylphenoxy)propyl]- 3- methyl- 8- [(2- methylpropyl)amino]- 3,7- dihydro- 2H- purin- 2- one
Smiles: OC(Cn1c(NCC(C)C)nc2c1c(O)nc(=O)n2C)COc1cccc(c1)C

STK588335
Synonyms: 4- {[(E)- (2- fluorophenyl)methylidene]amino}- 5- (3- methoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccccc1F

STK588337
Synonyms: N- (3,5- dimethoxyphenyl)- 2- {[5- (2- fluorophenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(OC)cc(c2)OC)nnc1c1ccccc1F

STK588338
Synonyms: 1- (4- chlorophenyl)- N- [(1S)- 3- (methylsulfanyl)- 1- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)propyl]cyclopentanecarboxamide
Smiles: CSCC[C@@H](c1nnc2n1cccc2)NC(=O)C1(CCCC1)c1ccc(cc1)Cl

STK588340
Synonyms: ethyl1'- (4- chlorophenyl)- 4'- hydroxy- 8- nitro- 2',6'- dioxo- 1,1',2,4,4a,6'- hexahydro- 2'H,3H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 3- carboxylate
Smiles: CCOC(=O)N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O

STK588341
Synonyms: (2Z)- N- (1,3- benzodioxol- 5- ylmethyl)- 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)NCc1ccc2c(c1)OCO2

STK588342
Synonyms: 8- ethyl- N- (3- methoxypropyl)- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- amine
Smiles: COCCCNc1nc2nnnn2c2c1c1CCN(Cc1s2)CC

STK588343
Synonyms: 4- [({1- [3- (4- methyl- 2- oxo- 6,7,8,9- tetrahydro- 2H- [1]benzofuro[3,2- g]chromen- 3- yl)propanoyl]piperidin- 4- yl}carbonyl)amino]butanoicacid
Smiles: OC(=O)CCCNC(=O)C1CCN(CC1)C(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2

STK588344
Synonyms: (5E)- 3- cyclohexyl- 5- [1- (2,3- dihydro- 1H- inden- 5- ylamino)propylidene]- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)C1CCCCC1)O)/Nc1ccc2c(c1)CCC2

STK588345
Synonyms: 3- chloro- N- [(2Z)- 3- [(pyridin- 2- ylmethyl)amino]quinoxalin- 2(1H)- ylidene]benzenesulfonamide
Smiles: Clc1cccc(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1NCc1ccccn1

STK588346
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- {[5- (2- chlorophenyl)- 4- (4- ethoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1c1ccccc1Cl

STK588347
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,N- diphenylacetamide
Smiles: N#Cc1c2CC(C)(C)OCc2c2n(c1Nc1ccccc1)c(SCC(=O)N(c1ccccc1)c1ccccc1)nn2

STK588348
Synonyms: 8- {[benzyl(methyl)amino]methyl}- 7- (2- fluorobenzyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CN(Cc1nc2c(n1Cc1ccccc1F)c(=O)n(c(=O)n2C)C)Cc1ccccc1

STK588349
Synonyms: (4E)- 2- (2,5- dimethoxyphenyl)- 4- ({[2- (4- methoxyphenyl)ethyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc(cc1)CCN/C=C/1\c2ccccc2C(=O)N(C1=O)c1cc(OC)ccc1OC

STK588350
Synonyms: 2- [(4- tert- butylbenzyl)sulfanyl]- 3- (4- methylphenyl)quinazolin- 4(3H)- one
Smiles: Cc1ccc(cc1)n1c(SCc2ccc(cc2)C(C)(C)C)nc2c(c1=O)cccc2

STK588351
Synonyms: (5E)- 3- (4- bromophenyl)- 6- hydroxy- 5- [(1- propyl- 1,2,3,4- tetrahydroquinolin- 6- yl)methylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: CCCN1CCCc2c1ccc(c2)/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)Br)O

STK588352
Synonyms: 6- hydroxy- 3- methyl- 8- [(2- methylpropyl)sulfanyl]- 7- pentyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCCCn1c(SCC(C)C)nc2c1c(O)nc(=O)n2C

STK588354
Synonyms: 11- (furan- 2- yl)- 10- methyl- 8- phenyl- 2- (pyridin- 4- yl)- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1nn(c2c1C(c1ccco1)c1c(O2)ncn2c1nc(n2)c1ccncc1)c1ccccc1

STK588356
Synonyms: 4- {[(2'S,3S,3'S,10b'R)- 2- oxo- 2'- (pyridin- 3- ylcarbonyl)- 1,2,2',3'- tetrahydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 3'- yl]carbonyl}phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccnc1)C(=O)Nc1c2cccc1)cccc3

STK588357
Synonyms: N'- [(E)- (2,3- dimethoxyphenyl)methylidene]- 4,6- dimethoxy- 1H- indole- 2- carbohydrazide
Smiles: COc1cc(OC)c2c(c1)[nH]c(c2)C(=O)N/N=C/c1cccc(c1OC)OC

STK588358
Synonyms: N- {2- [4- (4- methoxyphenyl)piperazin- 1- yl]ethyl}- 3- methyl- 2- oxo- 2,3- dihydro- 1,3- benzoxazole- 6- sulfonamide
Smiles: COc1ccc(cc1)N1CCN(CC1)CCNS(=O)(=O)c1ccc2c(c1)oc(=O)n2C

STK588359
Synonyms: 2- (2,3- dimethylbutan- 2- yl)- 5- methylphenylphenylcarbamate
Smiles: O=C(Oc1cc(C)ccc1C(C(C)C)(C)C)Nc1ccccc1

STK588360
Synonyms: 2- ethyl- 3- (2- methoxyethyl)- 4H- thiochromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COCCn1c(CC)nc2c(c1=O)c(=O)c1c(s2)cccc1

STK588361
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- phenylacetamide
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2CC(=O)Nc1ccccc1

STK588365
Synonyms: (5Z)- 3- [4- (azepan- 1- yl)- 4- oxobutyl]- 5- (2- chlorobenzylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\c2ccccc2Cl)/C(=O)N1CCCC(=O)N1CCCCCC1

STK588366
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4- dichlorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK588367
Synonyms: ethylN- [({5- [(4- chlorophenoxy)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetyl]glycinate
Smiles: C=CCn1c(SCC(=O)NCC(=O)OCC)nnc1COc1ccc(cc1)Cl

STK588369
Synonyms: 8- (4- methoxybenzyl)- 1,7- dimethyl- 3- (3- methylbutyl)- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COc1ccc(cc1)Cn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCC(C)C

STK588370
Synonyms: N- (2,5- 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)Cc1cc(OC)ccc1OC

STK588371
Synonyms: 3- (furan- 2- ylmethyl)- 2- {[2- (2- hydroxyethoxy)ethyl]amino}- 3,5,6,7,8,9- hexahydro- 4H- cyclohepta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: OCCOCCNc1nc2sc3c(c2c(=O)n1Cc1ccco1)CCCCC3

STK588372
Synonyms: 2- [2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)- 2- oxoethoxy]benzonitrile
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)COc1ccccc1C#N

STK588375
Synonyms: (3a'S,6a'R)- 6- chloro- 3'- (1- hydroxyethyl)- 5'- (2- methoxybenzyl)- 7- 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: COc1ccccc1CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(O)C)C(=O)Nc2c1ccc(c2C)Cl

STK588376
Synonyms: 5- propyl- N- [(2E)- 4,6,7- trimethylquinazolin- 2(1H)- ylidene]- 1,4,5,6- tetrahydro- 1,3,5- triazin- 2- amine
Smiles: CCCN1CNC(=NC1)/N=c\1/nc(C)c2c([nH]1)cc(c(c2)C)C

STK588378
Synonyms: 4- methoxy- N- [3- (1H- tetrazol- 1- yl)phenyl]benzamide
Smiles: COc1ccc(cc1)C(=O)Nc1cccc(c1)n1cnnn1

STK588379
Synonyms: (1'R,2'R)- 2'- (4- 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]1c1ccc(cc1)Cl)C(=O)c1c(C2=O)cccc1

STK588380
Synonyms: (4E)- 5- (2- fluorophenyl)- 4- [furan- 2- yl(hydroxy)methylidene]- 1- [5- (prop- 2- en- 1- ylsulfanyl)- 1,3,4- thiadiazol- 2- yl]pyrrolidine- 2,3- dione
Smiles: C=CCSc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2ccco2)/O)/C1c1ccccc1F

STK588381
Synonyms: 1'- butyl- 6- hydroxy- 6'- nitro- 3- (prop- 2- en- 1- yl)- 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)CC=C)O)[N+](=O)[O-]

STK588382
Synonyms: 7'- {[(E)- (1- ethyl- 4,6- dioxo- 2- sulfanyl- 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)- trione
Smiles: CCN1C(=NC(=O)/C(=C\Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)S

STK588383
Synonyms: 2- [(6- chloro- 4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (3- hydroxypropyl)acetamide
Smiles: Cc1cc(=O)oc2c1cc(Cl)c(c2)OCC(=O)NCCCO

STK588384
Synonyms: 2- (6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)- N- [4- methyl- 3- (morpholin- 4- ylsulfonyl)phenyl]acetamide
Smiles: COc1cc2c(cc1OC)CCN(C2C)CC(=O)Nc1ccc(c(c1)S(=O)(=O)N1CCOCC1)C

STK588386
Synonyms: N- (7- methyl- 2,3- dihydro- 1H- pyrrolo[2,3- b]quinolin- 1- yl)thiophene- 2- carboxamide
Smiles: Cc1ccc2c(c1)nc1c(c2)CCN1NC(=O)c1cccs1

STK588388
Synonyms: 6- phenyl- 9- (2,3,4- trimethoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1ccc(c(c1OC)OC)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1

STK588390
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (2- chloro- 6- fluorophenyl)methylidene]- 5- (4- propoxyphenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1c(F)cccc1Cl

STK588391
Synonyms: N- [2- (morpholin- 4- yl)ethyl]- 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)sc2c1CCCC2)NCCN1CCOCC1

STK588394
Synonyms: 7- (4- chlorobenzyl)- 8- [(2E)- 2- (4- chlorobenzylidene)hydrazinyl]- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Clc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1ccc(cc1)Cl)c(O)nc(=O)n2C

STK588395
Synonyms: 8- amino- N- (2- chlorophenyl)- 3,4- dihydro- 2H- 1,4- ethanothieno[2,3- b][1,5]naphthyridine- 7- carboxamide
Smiles: O=C(c1sc2c(c1N)cc1c(n2)C2CCN1CC2)Nc1ccccc1Cl

STK588396
Synonyms: 2- {[2- (3- methoxyphenyl)- 7,7- dimethyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}- N- (2- methylphenyl)acetamide
Smiles: COc1cccc(c1)c1nc(SCC(=O)Nc2ccccc2C)c2c(n1)CC(OC2)(C)C

STK588397
Synonyms: 7- (butan- 2- ylsulfanyl)- 5- tert- butyl- 2- methyl- 3- phenylpyrazolo[1,5- a]pyrimidine
Smiles: CCC(Sc1cc(nc2n1nc(c2c1ccccc1)C)C(C)(C)C)C

STK588399
Synonyms: 2- [6- (propan- 2- yl)- 1,3- benzothiazol- 2- yl]- 1- (3,4,5- trimethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cc(cc(c1OC)OC)C1N(c2nc3c(s2)cc(cc3)C(C)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK588400
Synonyms: 2- {[2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)- 2- oxoethyl]sulfanyl}- 3- propylquinazolin- 4(3H)- one
Smiles: CCCn1c(SCC(=O)N2CCc3c(C2)cc(c(c3)OC)OC)nc2c(c1=O)cccc2

STK588401
Synonyms: 2- [(3a'S,6a'R)- 5- chloro- 5'- (3- methoxypropyl)- 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: COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1cc(Cl)cc2

STK588402
Synonyms: 1- (2- fluorophenyl)- 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(C1c1ccccc1F)c(=O)c1c(o2)cccc1

STK588403
Synonyms: 9- (2- chlorophenyl)- 6- (4- fluorophenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Fc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2ccccc2Cl)ncn3)C1)O

STK588404
Synonyms: 6- butyl- 1- (2- phenylethyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: CCCCN1CNc2c(C1)c(=O)nc(n2CCc1ccccc1)S

STK588405
Synonyms: 1,3- dimethyl- 8- [(4- methylpiperidin- 1- yl)methyl]- 7- (2- phenylethyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC1CCN(CC1)Cc1nc2c(n1CCc1ccccc1)c(=O)n(c(=O)n2C)C

STK588406
Synonyms: 2- hydroxy- 7- methoxy- 3- {[(E)- (4- methoxyphenyl)methylidene]amino}- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc(cc1)/C=N/n1c(O)nc2c(c1=O)[nH]c1c2ccc(c1)OC

STK588407
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 2- ylmethyl)- N'- (4- methoxyphenyl)ethanediamide
Smiles: COc1ccc(cc1)NC(=O)C(=O)NCC1COc2c(O1)cccc2

STK588408
Synonyms: 8- [(4- ethylpiperazin- 1- yl)methyl]- 7- heptyl- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCCCCn1c(CN2CCN(CC2)CC)nc2c1c(=O)n(c(=O)n2C)C

STK588409
Synonyms: 4- [1- methyl- 4- (3- nitrophenyl)- 2,5- dioxo- 1,2,3,4,5,7- hexahydro- 6H- pyrrolo[3,4- d]pyrimidin- 6- yl]benzenesulfonamide
Smiles: O=C1NC(c2cccc(c2)[N+](=O)[O-])C2=C(N1C)CN(C2=O)c1ccc(cc1)S(=O)(=O)N

STK588411
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(4- chlorophenyl)carbonyl]- 2'- (thiophen- 2- ylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccs1)C(=O)Nc1c2cccc1)cccc3

STK588413
Synonyms: 2- [2- amino- 5- (3- methoxyphenoxy)- 6- methylpyrimidin- 4- yl]- 5- [(2- methylprop- 2- en- 1- yl)oxy]phenol
Smiles: COc1cccc(c1)Oc1c(C)nc(nc1c1ccc(cc1O)OCC(=C)C)N

STK588414
Synonyms: 1- (4- fluorophenyl)- 6- (2- methoxyethyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: COCCN1CNc2c(C1)c(=O)nc(n2c1ccc(cc1)F)S

STK588415
Synonyms: 3- [(Z)- (3- methyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 2- (4- phenylpiperazin- 1- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: S=C1S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2)/C(=O)N1C

STK588416
Synonyms: 5- (3- chlorophenyl)- 4- {[(E)- (2- fluorophenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccccc1F

STK588417
Synonyms: 2- amino- 4- (3- bromo- 4- methoxyphenyl)- 5- hydroxy- 7- methyl- 4H- pyrano[3,2- c]pyridine- 3- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(c(c1)Br)OC)c(O)nc(c2)C

STK588418
Synonyms: 2- {[4- (4- methoxyphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc3c2cccc3)nnc1Cc1cccs1

STK588420
Synonyms: N- benzyl- 4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- phenylbutanamide
Smiles: O=C(N(c1ccccc1)Cc1ccccc1)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK588421
Synonyms: 8- amino- 1',3'- dimethyl- 1,2,4,4a- tetrahydro- 2'H,6H- spiro[1,4- oxazino[4,3- a]quinoline- 5,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: Nc1ccc2c(c1)CC1(C3N2CCOC3)C(=O)N(C)C(=O)N(C1=O)C

STK588423
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK588424
Synonyms: N,N- dimethyl- 3- [(2- phenyl- 6,7- dihydro- 5H- cyclopenta[d]pyrimidin- 4- yl)sulfanyl]propan- 1- amine
Smiles: CN(CCCSc1nc(nc2c1CCC2)c1ccccc1)C

STK588425
Synonyms: 9- (2,3- 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)C2c1cccc(c1OC)OC

STK588427
Synonyms: 4- [4- (benzyloxy)phenyl]- 2- [(2- chlorobenzyl)sulfanyl]- 6- hydroxy- 4,5- dihydropyridine- 3- carbonitrile
Smiles: N#CC1=C(SCc2ccccc2Cl)N=C(CC1c1ccc(cc1)OCc1ccccc1)O

STK588428
Synonyms: 4- {[(E)- (5- bromo- 2- hydroxyphenyl)methylidene]amino}- 5- (2- bromophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Brc1ccc(c(c1)/C=N/n1c(=S)[nH]nc1c1ccccc1Br)O

STK588431
Synonyms: (2Z)- 1- (6- chloropyridin- 3- yl)- 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 1(2H)- ylidene)ethanone
Smiles: COc1cc2/C(=C/C(=O)c3ccc(nc3)Cl)/NCCc2cc1OC

STK588432
Synonyms: 5- (2- chlorophenyl)- 4- ({(E)- [4- (pentyloxy)phenyl]methylidene}amino)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCCCCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

STK588433
Synonyms: 8- [(3,4- dimethylphenyl)sulfonyl]- 3,4,7,8,9,10- hexahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline
Smiles: Cc1cc(ccc1C)S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1

STK588434
Synonyms: 8- (4- ethoxyphenyl)- 1- methyl- 3- (3- phenylpropyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCCc1ccccc1

STK588435
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK588436
Synonyms: 2- [4- (2- fluorophenyl)piperazin- 1- yl]- N- [(2Z)- 4- (4- methylphenyl)- 1,3- thiazol- 2(3H)- ylidene]acetamide
Smiles: Cc1ccc(cc1)c1cs/c(=N\C(=O)CN2CCN(CC2)c2ccccc2F)/[nH]1

STK588438
Synonyms: N- (3,4- dimethoxyphenyl)- 2- {[4- ethyl- 5- (2- fluorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CSc1nnc(n1CC)c1ccccc1F

STK588439
Synonyms: 1- (2,3- dimethoxyphenyl)- 2- (6- ethyl- 1,3- benzothiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccc(c1OC)OC)c(=O)c1c(o2)cccc1

STK588441
Synonyms: 8- (4- chlorophenyl)- 11- (furan- 2- yl)- 2- [(4- methoxyphenoxy)methyl]- 10- methyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccc(cc1)OCc1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccc(cc1)Cl

STK588443
Synonyms: 5- methyl- 7- (3- methylphenyl)benzimidazo[1',2':1,6]pyrimido[4,5- b]quinolin- 14(5H)- one
Smiles: Cc1cccc(c1)c1nc2n(C)c3ccccc3c(=O)c2c2n1c1ccccc1n2

STK588445
Synonyms: 1- (4- fluorophenyl)- 2- hydroxy- 6- (3- phenylpropyl)- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: Fc1ccc(cc1)n1c(O)nc(=O)c2c1NCN(C2)CCCc1ccccc1

STK588446
Synonyms: 1- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)- 2- [(6- ethoxy- 1,3- benzothiazol- 2- yl)sulfanyl]ethanone
Smiles: CCOc1ccc2c(c1)sc(n2)SCC(=O)N1CCc2c(C1)cc(c(c2)OC)OC

STK588447
Synonyms: 3- (7- hydroxy- 4,8- dimethyl- 2- oxo- 2H- chromen- 3- yl)- N- [3- (1H- imidazol- 1- yl)propyl]propanamide
Smiles: O=C(CCc1c(=O)oc2c(c1C)ccc(c2C)O)NCCCn1cncc1

STK588449
Synonyms: 4,8- dimethyl- 2- oxo- 2H- chromen- 7- ylN- [(4- chlorophenyl)sulfonyl]- beta- alaninate
Smiles: O=C(Oc1ccc2c(c1C)oc(=O)cc2C)CCNS(=O)(=O)c1ccc(cc1)Cl

STK588450
Synonyms: 2- ({4- amino- 5- [5- (4- chlorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- chloro- 4,6- dimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cc(cc1Cl)C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK588451
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- [(7- methyl- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 9- yl)oxy]acetamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)COc1cc(C)cc2c1c1CCCc1c(=O)o2

STK588454
Synonyms: 3- (3- chlorophenyl)- 4- (4- chlorophenyl)- 5- [(4- methoxybenzyl)sulfanyl]- 4H- 1,2,4- triazole
Smiles: COc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK588455
Synonyms: N- [4- (4- chlorophenyl)- 6- methyl- 5- oxo- 2- phenyl- 2,5- dihydropyridazin- 3- yl]benzamide
Smiles: Clc1ccc(cc1)c1c(=O)c(C)nn(c1NC(=O)c1ccccc1)c1ccccc1

STK588456
Synonyms: 2- [(3a'S,6a'R)- 5'- (butan- 2- yl)- 5- fluoro- 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: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1cc(F)cc2)C

STK588457
Synonyms: (6E)- 4- (1- benzofuran- 2- yl)- 6- [(3- methoxyphenyl)imino]- 1,6- dihydro- 1,3,5- triazin- 2- amine
Smiles: COc1cccc(c1)/N=c/1\[nH]c(N)nc(n1)c1cc2c(o1)cccc2

STK588462
Synonyms: 2- (7- methyl- 3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(CN1CCc2c(C1C)cc1c(c2)OCCCO1)Nc1cccc(c1)C(F)(F)F

STK588464
Synonyms: methyl3- [8- (3- methoxyphenyl)- 1,7- dimethyl- 2,4- dioxo- 1,2,4,8- tetrahydro- 3H- imidazo[2,1- f]purin- 3- yl]propanoate
Smiles: COC(=O)CCn1c(=O)c2n3cc(n(c3nc2n(c1=O)C)c1cccc(c1)OC)C

STK588465
Synonyms: 8- [(2- ethoxyethyl)sulfanyl]- 6- hydroxy- 3- methyl- 7- pentyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCCCn1c(SCCOCC)nc2c1c(O)nc(=O)n2C

STK588466
Synonyms: (2'S,3S,3'S,10b'R)- 2'- {[3- (prop- 2- en- 1- yloxy)phenyl]carbonyl}- 3'- (pyridin- 2- ylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: C=CCOc1cccc(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccccn2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK588469
Synonyms: 5- (2- chlorophenyl)- 4- {[(E)- (3,4,5- trimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(/C=N/n2c(=S)[nH]nc2c2ccccc2Cl)cc(c1OC)OC

STK588471
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- ethylphenyl)acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK588472
Synonyms: 1- (4- ethoxyphenyl)- N- (3- methylphenyl)- 4- (4- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCOc1ccc(cc1)c1c(C(=O)Nc2cccc(c2)C)n2c3c1CCCCn3c(c2)c1ccc(cc1)C

STK588477
Synonyms: 8- hydrazinyl- 6- hydroxy- 7- [2- hydroxy- 3- (4- methylphenoxy)propyl]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: NNc1nc2c(n1CC(COc1ccc(cc1)C)O)c(O)nc(=O)n2C

STK588478
Synonyms: (1'S,2'S,3R,3a'R)- 1'- acetyl- 7'- methyl- 2'- [(4- pentylphenyl)carbonyl]- 1',2'- dihydro- 3a'H- spiro[indole- 3,3'- pyrrolo[1,2- a]quinolin]- 2(1H)- one
Smiles: CCCCCc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)C)N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)C

STK588480
Synonyms: 2- (4- chlorophenoxy)- 9,10- dimethoxy- 6,7- dihydro- 4H- pyrimido[6,1- a]isoquinolin- 4- one
Smiles: COc1cc2c(cc1OC)CCn1c2cc(Oc2ccc(cc2)Cl)nc1=O

STK588482
Synonyms: (5Z)- 5- (4- ethoxy- 3- methoxybenzylidene)- 3- (morpholin- 4- yl)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCOc1ccc(cc1OC)/C=C/1\SC(=S)N(C1=O)N1CCOCC1

STK588483
Synonyms: N- methyl- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzenesulfonamide
Smiles: O=c1[nH]c2ccccc2cc1CN(S(=O)(=O)c1ccccc1)C

STK588484
Synonyms: 2- {[2- (4- methoxyphenyl)- 7,7- dimethyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}- N- (pyridin- 2- yl)acetamide
Smiles: COc1ccc(cc1)c1nc(SCC(=O)Nc2ccccn2)c2c(n1)CC(OC2)(C)C

STK588486
Synonyms: 7- (2- fluorophenyl)- 10- (methylsulfanyl)- 6- (thiophen- 2- yl)- 7,11- dihydro- 6H- chromeno[4,3- d][1,2,4]triazolo[1,5- a]pyrimidine
Smiles: CSc1nn2c(=NC3=C(C2c2ccccc2F)C(Oc2c3cccc2)c2cccs2)[nH]1

STK588487
Synonyms: 2- amino- 4- (2,6- dichlorophenyl)- 5- hydroxy- 7- methyl- 4H- pyrano[3,2- c]pyridine- 3- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1c(Cl)cccc1Cl)c(O)nc(c2)C

STK588488
Synonyms: 2- {[4- (4- chlorophenyl)- 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)Cl)Cc1cccs1

STK588490
Synonyms: (8aR)- 7- (2- fluorobenzyl)tetrahydro[1,3]thiazolo[3,4- a]pyrazine- 5,8- dione
Smiles: O=C1N(CC(=O)N2[C@H]1CSC2)Cc1ccccc1F

STK588491
Synonyms: 4- (3- chloro- 4- fluorophenyl)- 5- (6- hydroxypyridazin- 3- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Oc1ccc(nn1)c1n[nH]c(=S)n1c1ccc(c(c1)Cl)F

STK588492
Synonyms: N- (3,5- dimethylphenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(C)cc(c1)C)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK588493
Synonyms: (2E)- 1- (6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)- 3- (thiophen- 2- yl)prop- 2- en- 1- one
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=O)/C=C/c1cccs1

STK588494
Synonyms: 7- bromo- 1- (4- ethoxyphenyl)- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Br

STK588495
Synonyms: (2E)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 3- (3,5- dichloro- 4- hydroxyphenyl)prop- 2- enenitrile
Smiles: N#C/C(=C\c1cc(Cl)c(c(c1)Cl)O)/c1scc(n1)c1ccc2c(c1)OCO2

STK588496
Synonyms: 1- [(2,4- dichlorobenzyl)sulfanyl]- 4- phenyl- 7,8- dihydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 5(4H)- one
Smiles: Clc1ccc(c(c1)Cl)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCC3

STK588497
Synonyms: N- {[1- (tert- butoxycarbonyl)- 4- phenylpiperidin- 4- yl]carbonyl}- L- leucyl- L- asparagine
Smiles: CC(C[C@@H](C(=O)N[C@H](C(=O)O)CC(=O)N)NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1)C

STK588498
Synonyms: (2E)- 2- [(2E)- (2- chloro- 6- fluorobenzylidene)hydrazinylidene]- 4- (3- nitrophenyl)- 2,3- dihydro- 1,3- thiazole
Smiles: Fc1cccc(c1/C=N/N=c\1/scc([nH]1)c1cccc(c1)[N+](=O)[O-])Cl

STK588499
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3,5- dimethylphenyl)acetamide
Smiles: O=C(Nc1cc(C)cc(c1)C)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)Cl

STK588501
Synonyms: N- (furan- 2- ylmethyl)- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]thiophene- 2- carboxamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1cccs1)Cc1ccco1

STK588504
Synonyms: 3- [(3a'S,6a'R)- 5'- butyl- 5- fluoro- 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: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1cc(F)cc2

STK588505
Synonyms: 7- {(E)- [2- (2,4,6- trichlorophenyl)hydrazinylidene]methyl}[1,3]dioxolo[4,5- g]quinolin- 6- ol
Smiles: Clc1cc(Cl)c(c(c1)Cl)N/N=C/c1cc2cc3OCOc3cc2nc1O

STK588507
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK588508
Synonyms: 8- (2,4- dimethoxyphenyl)- 1- methyl- 3- (2- phenylethyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: COc1cc(OC)ccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCc1ccccc1

STK588509
Synonyms: 9- (3- chlorophenyl)- 6- (4- fluorophenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Fc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2cccc(c2)Cl)ncn3)C1)O

STK588511
Synonyms: 7'- methoxy- 7- [(4- nitrobenzyl)oxy]- 2H,2'H- 3,4'- bichromene- 2,2'- dione
Smiles: COc1ccc2c(c1)oc(=O)cc2c1cc2ccc(cc2oc1=O)OCc1ccc(cc1)[N+](=O)[O-]

STK588512
Synonyms: N'- [(E)- (2- hydroxy- 3- methoxyphenyl)methylidene]- 5,6- dimethoxy- 1H- indole- 2- carbohydrazide
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)N/N=C/c1cccc(c1O)OC

STK588513
Synonyms: N- benzyl- 2- {[2- (methylsulfanyl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl]sulfanyl}acetamide
Smiles: CSc1nc(SCC(=O)NCc2ccccc2)c2c(n1)sc1c2CCCC1

STK588515
Synonyms: 3- (3- chlorophenyl)- 2- [4- (2- hydroxyethyl)piperazin- 1- yl]- 7- methyl- 5,6,7,8- tetrahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: OCCN1CCN(CC1)c1nc2sc3c(c2c(=O)n1c1cccc(c1)Cl)CCN(C3)C

STK588516
Synonyms: 2- (4- fluorophenyl)- 3- (furan- 2- ylmethyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: Fc1ccc(cc1)c1nc2oc3ccccc3c(=O)c2c(=O)n1Cc1ccco1

STK588517
Synonyms: 1- amino- 4- (propan- 2- ylamino)- 2- (pyrrolidin- 1- yl)anthracene- 9,10- dione
Smiles: CC(Nc1cc(N2CCCC2)c(c2c1C(=O)c1ccccc1C2=O)N)C

STK588518
Synonyms: N- [6,6- dimethyl- 2,4- dioxo- 1- (pyridin- 2- ylmethyl)- 3- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- indol- 3- yl]acetamide
Smiles: CC(=O)NC1(C(=O)N(C2=C1C(=O)CC(C2)(C)C)Cc1ccccn1)C(F)(F)F

STK588519
Synonyms: N- [3- (3,4- dimethoxyphenyl)- 1- methyl- 4- oxo- 1,4- dihydroquinolin- 2- yl]- 2- phenylacetamide
Smiles: COc1cc(ccc1OC)c1c(NC(=O)Cc2ccccc2)n(C)c2c(c1=O)cccc2

STK588521
Synonyms: 4- {[(E)- (2,6- dichlorophenyl)methylidene]amino}- 5- [3- (propan- 2- yloxy)phenyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1c(Cl)cccc1Cl)C

STK588522
Synonyms: (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]isoindole- 6- carboxamide
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)C(=O)N

STK588523
Synonyms: (3a'S,6a'R)- 5'- butyl- 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: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cc(F)cc2

STK588524
Synonyms: 4- hydroxy- 8- (2- methoxyethyl)- 1,6,7- trimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: COCCn1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK588526
Synonyms: 8- [4- (3- chlorobenzyl)piperazin- 1- yl]- 6- hydroxy- 7- (2- methoxyethyl)- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: COCCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1cccc(c1)Cl

STK588527
Synonyms: methyl4- [(3E)- 3- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 1- (5- methyl- 1,3,4- thiadiazol- 2- yl)- 4,5- dioxopyrrolidin- 2- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)C

STK588528
Synonyms: (2E)- N- [(2E)- 6- nitro- 1,3- benzothiazol- 2(3H)- ylidene]- 3- phenylprop- 2- enamide
Smiles: O=C(/N=c\1/sc2c([nH]1)ccc(c2)[N+](=O)[O-])/C=C/c1ccccc1

STK588529
Synonyms: N- (3- fluoro- 4- methylphenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)F)C)CSc1nnc(n1Cc1ccco1)Cc1cccs1

STK588530
Synonyms: 3- (4- chlorophenyl)- 12- (pyridin- 3- yl)- 2,3,4,12- tetrahydrobenzimidazo[2,1- b]quinazolin- 1- ol
Smiles: Clc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2cccnc2)c2c(n3)cccc2)C1)O

STK588531
Synonyms: ethyl2- (3- {(Z)- [4,6- dioxo- 1- (prop- 2- en- 1- yl)- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}- 2,5- dimethyl- 1H- pyrrol- 1- yl)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: C=CCN1C(=NC(=O)/C(=C/c2cc(n(c2C)c2sc3c(c2C(=O)OCC)CCCC3)C)/C1=O)S

STK588532
Synonyms: ethyl5- ethyl- 2- [(3- {4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}quinoxalin- 2- yl)amino]thiophene- 3- carboxylate
Smiles: CCOC(=O)c1cc(sc1Nc1nc2ccccc2nc1N1CCN(CC1)C/C=C/c1ccccc1)CC

STK588534
Synonyms: (4E)- 1- (3- chloro- 4- methylphenyl)- 4- [hydroxy(phenyl)methylidene]- 5- (4- methoxyphenyl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1ccc(c(c1)Cl)C

STK588535
Synonyms: 3- (5,9- dimethyl- 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: CN1CCc2c(C1)sc1c2c2nc(nn2c(n1)C)c1cccc(c1)O

STK588537
Synonyms: 6- methoxy- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- (3- nitrophenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)C(N(C1=O)c1noc(c1)C)c1cccc(c1)[N+](=O)[O-]

STK588540
Synonyms: N- (2,4- dimethylphenyl)- 1- ({1- [(4- methylphenyl)sulfonyl]piperidin- 4- yl}carbonyl)- L- prolinamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1CCC[C@H]1C(=O)Nc1ccc(cc1C)C

STK588542
Synonyms: (2S,3R)- 2- (3- chlorophenyl)- 3- (tricyclo[3.3.1.1~3,7~]dec- 1- ylcarbonyl)cyclopropane- 1,1- dicarbonitrile
Smiles: N#CC1(C#N)[C@@H]([C@H]1C(=O)C12CC3CC(C2)CC(C1)C3)c1cccc(c1)Cl

STK588543
Synonyms: 4- {[(E)- (4- propoxyphenyl)methylidene]amino}- 5- (pyridin- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccn1

STK588544
Synonyms: 4- methyl- 6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 3- yl[(tert- butoxycarbonyl)amino](phenyl)acetate
Smiles: O=C(OC(C)(C)C)NC(c1ccccc1)C(=O)Oc1ccc2c(c1C)oc(=O)c1c2CCCC1

STK588545
Synonyms: 1- (4- chlorophenyl)- 6- (1- phenylethyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: Clc1ccc(cc1)n1c(S)nc(=O)c2c1NCN(C2)C(c1ccccc1)C

STK588546
Synonyms: (2,6- dichloropyridin- 4- yl)(6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=O)c1cc(Cl)nc(c1)Cl

STK588547
Synonyms: N- (4- nitrophenyl)- 3- (4- oxoquinazolin- 3(4H)- yl)propanamide
Smiles: O=C(Nc1ccc(cc1)[N+](=O)[O-])CCn1cnc2c(c1=O)cccc2

STK588548
Synonyms: N- [(2S)- 1- (benzylamino)- 3- methyl- 1- oxobutan- 2- yl]- 2,3- dihydro- 1H- imidazo[1,2- a]benzimidazole- 1- carboxamide
Smiles: CC([C@@H](C(=O)NCc1ccccc1)NC(=O)N1CCn2c1nc1c2cccc1)C

STK588550
Synonyms: N- [(2Z)- 5- [(4- chlorobenzyl)sulfonyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- (naphthalen- 1- yl)acetamide
Smiles: Clc1ccc(cc1)CS(=O)(=O)c1n[nH]/c(=N/C(=O)Cc2cccc3c2cccc3)/s1

STK588551
Synonyms: (4E)- 5- (3- fluorophenyl)- 1- (furan- 2- ylmethyl)- 4- [hydroxy(3- nitrophenyl)methylidene]pyrrolidine- 2,3- dione
Smiles: Fc1cccc(c1)C1N(Cc2ccco2)C(=O)C(=O)/C/1=C(\c1cccc(c1)[N+](=O)[O-])/O

STK588552
Synonyms: 2- ({4- amino- 5- [5- (4- chlorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3- chlorophenyl)acetamide
Smiles: O=C(Nc1cccc(c1)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK588553
Synonyms: N- (4- butylphenyl)- 2- {[4- (4- chlorophenyl)- 5- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)OC

STK588557
Synonyms: 4- ({(E)- [4- (benzyloxy)phenyl]methylidene}amino)- 5- (2- chlorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)OCc1ccccc1

STK588558
Synonyms: 3- [(4- fluorobenzyl)sulfanyl]- 8,8- dimethyl- 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(SCc3ccc(cc3)F)nnc2c2c1CC(C)(C)OC2

STK588559
Synonyms: (4E)- 5- (4- bromophenyl)- 4- [hydroxy(phenyl)methylidene]- 1- (2- phenylethyl)pyrrolidine- 2,3- dione
Smiles: Brc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1CCc1ccccc1

STK588564
Synonyms: methyl4- [(3E)- 3- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 1- {5- [(4- methylbenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}- 4,5- dioxopyrrolidin- 2- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(c2nnc(s2)SCc2ccc(cc2)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK588565
Synonyms: 3'- (butan- 2- yl)- 6'- hydroxy- 4- methyl- 3,4- dihydro- 1H,2'H- spiro[benzo[f]quinoline- 2,5'- pyrimidine]- 2',4'(3'H)- dione
Smiles: CCC(N1C(=O)N=C(C2(C1=O)CN(C)c1c(C2)c2ccccc2cc1)O)C

STK588567
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 1- {5- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}- 5- [4- (propan- 2- yl)phenyl]pyrrolidine- 2,3- dione
Smiles: O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C(N1c1nnc(s1)SCc1cccc2c1cccc2)c1ccc(cc1)C(C)C

STK588568
Synonyms: 3- (3,4- dimethoxyphenyl)- 8- [(4- ethylpiperazin- 1- ium- 1- yl)methyl]- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- olate
Smiles: CCN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(c(c2=O)c1ccc(c(c1)OC)OC)C(F)(F)F

STK588569
Synonyms: 2- [3- (furan- 2- ylmethyl)- 4- imino- 6,6- dimethyl- 2- oxo- 3,4,5,8- tetrahydro- 2H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 1(6H)- yl]- N- (4- methylphenyl)acetamide
Smiles: O=C(Cn1c(=O)n(Cc2ccco2)c(=N)c2c1sc1c2CC(OC1)(C)C)Nc1ccc(cc1)C

STK588570
Synonyms: 3- (4- chlorobenzyl)- 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)Cc1ccc(cc1)Cl

STK588571
Synonyms: 2- ({4- (4- chlorophenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C(F)(F)F)nnc1COc1ccc(cc1)C

STK588572
Synonyms: 7- (2,5- dimethylphenyl)- 2- (pyridin- 4- yl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1ccc(c(c1)n1ncc2c1ncn1c2nc(n1)c1ccncc1)C

STK588573
Synonyms: 9- (3,5- difluorophenyl)- 2- (methylsulfanyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1cc(F)cc(c1)F

STK588574
Synonyms: 10- (1H- benzimidazol- 2- ylmethyl)- 11- (4- chlorophenyl)- 3,3- dimethyl- 3,4,10,11- tetrahydro- 2H- dibenzo[b,e][1,4]diazepin- 1- ol
Smiles: Clc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c(N1Cc1nc3c([nH]1)cccc3)cccc2)(C)C

STK588575
Synonyms: (2Z)- 2- (2- methylbenzylidene)- 7- (morpholin- 4- ium- 4- ylmethyl)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: O=C1/C(=C/c2ccccc2C)/Oc2c1ccc(c2C[NH+]1CCOCC1)[O-]

STK588578
Synonyms: 4- {[(E)- (4- tert- butylphenyl)methylidene]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)C(C)(C)C

STK588579
Synonyms: 11- (3,5- difluorophenyl)- 3,3- dimethyl- 3,4,10,11- tetrahydro- 2H- dibenzo[b,e][1,4]diazepin- 1- ol
Smiles: Fc1cc(F)cc(c1)C1Nc2ccccc2N=C2C1=C(O)CC(C2)(C)C

STK588580
Synonyms: (3- bromophenyl)(3,5,6,7- tetrahydro- 1'H- spiro[imidazo[4,5- c]pyridine- 4,4'- piperidin]- 1'- yl)methanone
Smiles: Brc1cccc(c1)C(=O)N1CCC2(CC1)NCCc1c2[nH]cn1

STK588581
Synonyms: 5,6- dimethoxy- N- (quinolin- 3- yl)- 1H- indole- 2- carboxamide
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)Nc1cnc2c(c1)cccc2

STK588582
Synonyms: N- (2,3- dimethylphenyl)- 2- {[4- (4- methoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2C)C)nnc1c1cccc(c1)C

STK588583
Synonyms: 4- chloro- N- (4- methylphenyl)- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzenesulfonamide
Smiles: Cc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)Cl)Cc1cc2ccccc2[nH]c1=O

STK588584
Synonyms: 1- (3- {[6- (4- acetyl- 5- methyl- 1H- pyrazol- 1- yl)pyrimidin- 4- yl]amino}phenyl)ethanone
Smiles: CC(=O)c1cccc(c1)Nc1ncnc(c1)n1ncc(c1C)C(=O)C

STK588585
Synonyms: 3- (7- hydroxy- 4,8- dimethyl- 2- oxo- 2H- chromen- 3- yl)- N- [2- (morpholin- 4- yl)ethyl]propanamide
Smiles: O=C(NCCN1CCOCC1)CCc1c(=O)oc2c(c1C)ccc(c2C)O

STK588587
Synonyms: 2- methylpropyl[4- (dimethylamino)phenyl][(2- methoxyphenyl)(phenylamino)methyl]phosphinate
Smiles: COc1ccccc1C(P(=O)(c1ccc(cc1)N(C)C)OCC(C)C)Nc1ccccc1

STK588588
Synonyms: N- (4- chlorophenyl)- 2- {[4- (4- chlorophenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)C

STK588589
Synonyms: 10- (furan- 2- yl)- 1,3,7,7- tetramethyl- 5- (4- methylphenyl)- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: Cc1ccc(cc1)c1c2c(=O)n(C)c(=O)n(c2c2n1C(C)(C)COC2c1ccco1)C

STK588591
Synonyms: {2- methoxy- 4- [(4Z)- 4- (5- oxo- 2- phenyl- 1,3- oxazol- 4(5H)- ylidene)- 4H- chromen- 2- yl]phenoxy}acetonitrile
Smiles: N#CCOc1ccc(cc1OC)C1=C/C(=C\2/N=C(OC2=O)c2ccccc2)/c2c(O1)cccc2

STK588593
Synonyms: 1- [(2R)- 2- (2,4- dioxo- 1,4- dihydroquinazolin- 3(2H)- yl)- 3- (1H- indol- 3- yl)propanoyl]piperidine- 4- carboxylicacid
Smiles: OC(=O)C1CCN(CC1)C(=O)[C@H](n1c(=O)[nH]c2c(c1=O)cccc2)Cc1c[nH]c2c1cccc2

STK588595
Synonyms: 12- (3,4- dimethoxyphenyl)- 2- (furan- 2- yl)- 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)c1ccco1

STK588596
Synonyms: (E)- N- {[8- (4- chlorophenyl)- 11- (furan- 2- yl)- 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- (4- methoxyphenyl)methanimine
Smiles: COc1ccc(cc1)/C=N/OCc1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccc(cc1)Cl

STK588597
Synonyms: 2- (10- fluoro- 6- oxo- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 7(6H)- yl)- N- (2- phenylethyl)acetamide
Smiles: O=C(Cn1c2ccc(cc2c2c1c(=O)n1CCCSc1n2)F)NCCc1ccccc1

STK588598
Synonyms: ethyl4- (2- chlorophenyl)- 5- cyano- 6- ({2- [(3,4- dichlorophenyl)amino]- 2- oxoethyl}sulfanyl)- 2- hydroxy- 3,4- dihydropyridine- 3- carboxylate
Smiles: CCOC(=O)C1C(=NC(=C(C1c1ccccc1Cl)C#N)SCC(=O)Nc1ccc(c(c1)Cl)Cl)O

STK588601
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 5- (3- phenyl- 1H- pyrazol- 5- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1c1ccc2c(c1)OCCO2)c1[nH]nc(c1)c1ccccc1

STK588602
Synonyms: 8,8- dimethyl- 5- [(4- methylphenyl)amino]- 3- [(2- oxo- 2- phenylethyl)sulfanyl]- 7,10- dihydro- 8H- pyrano[3,4- c][1,2,4]triazolo[4,3- a]pyridine- 6- carbonitrile
Smiles: N#Cc1c(Nc2ccc(cc2)C)n2c(SCC(=O)c3ccccc3)nnc2c2c1CC(C)(C)OC2

STK588603
Synonyms: 2- ({5- [(1S)- 1- amino- 3- (methylsulfanyl)propyl]- 1,3,4- oxadiazol- 2- yl}sulfanyl)- N- (2,5- dimethylphenyl)acetamide
Smiles: CSCC[C@@H](c1nnc(o1)SCC(=O)Nc1cc(C)ccc1C)N

STK588604
Synonyms: 4- (3- nitrophenyl)- 4,10- dihydro[1,3,5]triazino[1,2- a]benzimidazol- 2- amine
Smiles: NC1=NC(c2cccc(c2)[N+](=O)[O-])n2c(=N1)[nH]c1c2cccc1

STK588607
Synonyms: 8- (3,4- dimethylphenyl)- 3- (3- hydroxypropyl)- 1- methyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(c(c1)C)C

STK588609
Synonyms: 5- (2- fluorophenyl)- 4- {[(E)- (3- methylphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1ccccc1F

STK588611
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- chlorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- fluorophenyl)acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)F)nnc1c1cccc(c1)Cl

STK588613
Synonyms: 1- (4- hydroxy- 3- methoxyphenyl)- 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(C1c1ccc(c(c1)OC)O)c(=O)c1c(o2)cccc1

STK588614
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(4- methylphenyl)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(cc2)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK588615
Synonyms: (2E)- 3- (5- chloro- 1- methyl- 1H- imidazol- 2- yl)- 1- (4- hydroxyphenyl)prop- 2- en- 1- one
Smiles: Oc1ccc(cc1)C(=O)/C=C/c1ncc(n1C)Cl

STK588616
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)Cc1cccs1

STK588617
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- (2- nitrophenyl)acetamide
Smiles: N#Cc1c(Nc2ccc(cc2)C)n2c(SCC(=O)Nc3ccccc3[N+](=O)[O-])nnc2c2c1CC(C)(C)OC2

STK588618
Synonyms: 10- (2- hydroxy- 3- methoxyphenyl)- 1,3- dimethyl- 5- (4- methylphenyl)- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: COc1cccc(c1O)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1ccc(cc1)C)C

STK588620
Synonyms: 4- {[(E)- (4- ethoxy- 3- methoxyphenyl)methylidene]amino}- 5- (3,4,5- trimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1OC)/C=N/n1c(=S)[nH]nc1c1cc(OC)c(c(c1)OC)OC

STK588621
Synonyms: (3a'S,6a'R)- 5'- (butan- 2- yl)- 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: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(C)C)C(=O)Nc2c1cc(F)cc2)C

STK588622
Synonyms: 5- {4- [(4- chlorobenzyl)oxy]phenyl}- N'- {(E)- [4- (propan- 2- yl)phenyl]methylidene}- 1H- pyrazole- 3- carbohydrazide
Smiles: Clc1ccc(cc1)COc1ccc(cc1)c1[nH]nc(c1)C(=O)N/N=C/c1ccc(cc1)C(C)C

STK588627
Synonyms: (2Z)- 2- cyano- 3- (4- ethoxy- 3- methoxyphenyl)- N- (1,3- thiazol- 2- yl)prop- 2- enamide
Smiles: CCOc1ccc(cc1OC)/C=C(\C(=O)Nc1nccs1)/C#N

STK588629
Synonyms: 5- (morpholin- 4- yl)- 8- propyl- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidine
Smiles: CCCN1CCc2c(C1)sc1c2c(nc2n1nnn2)N1CCOCC1

STK588630
Synonyms: N- (prop- 2- en- 1- ylcarbamoyl)- L- methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)NCC=C

STK588632
Synonyms: (4E)- 2- (4- bromophenyl)- 4- {[(1,1- dioxidotetrahydrothiophen- 3- yl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: Brc1ccc(cc1)N1C(=O)/C(=C/NC2CCS(=O)(=O)C2)/c2c(C1=O)cccc2

STK588633
Synonyms: 6- chloro- 4- ethyl- 9- (pyridin- 2- ylmethyl)- 9,10- dihydro- 2H,8H- chromeno[8,7- e][1,3]oxazin- 2- one
Smiles: CCc1cc(=O)oc2c1cc(Cl)c1c2CN(CO1)Cc1ccccn1

STK588634
Synonyms: 3'- (4- ethoxyphenyl)- 6'- hydroxy- 2,4- dimethyl- 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: CCOc1ccc(cc1)N1C(=O)N=C(C2(C1=O)Cc1cc(ccc1N1C2C(C)OC(C1)C)[N+](=O)[O-])O

STK588635
Synonyms: 7'- {(E)- [1- (2,4- 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)C)N1C(=O)N=C(/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK588636
Synonyms: N- (3,4- dimethoxyphenyl)- 2- {[4- ethyl- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CSc1nnc(n1CC)Cc1cccs1

STK588637
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(2- chlorophenyl)carbonyl]- 3'- (pyridin- 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)c1ccccn1

STK588639
Synonyms: 7'- {(1E)- 3- [4,6- dihydroxy- 2- oxo- 1- (prop- 2- en- 1- yl)- 1,2- dihydropyrimidin- 5- yl]- 3- oxoprop- 1- en- 1- yl}- 1,3- dimethyl- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3
Smiles: C=CCn1c(=O)nc(c(c1O)C(=O)/C=C/c1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C)O

STK588642
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 1- {5- [(4- fluorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}- 5- [3- (pentyloxy)phenyl]pyrrolidine- 2,3- dione
Smiles: CCCCCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)F)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK588643
Synonyms: 2- (4- methoxyphenyl)- 5,6- dimethyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: COc1ccc(cc1)c1nc2n(n1)c(O)c(c(n2)C)C

STK588644
Synonyms: N- [(2,5- dimethyl- 7- oxo- 3- phenyl- 7H- furo[3,2- g]chromen- 6- yl)acetyl]glycyl- S- benzyl- D- cysteine
Smiles: O=C(N[C@@H](C(=O)O)CSCc1ccccc1)CNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1c1ccccc1)C

STK588645
Synonyms: 3- (4- chlorobenzyl)- 8- (2,4- dimethoxyphenyl)- 1- methyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: COc1cc(OC)ccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)Cl

STK588647
Synonyms: 5- bromo- N- (1- imino- 1,3- dihydro- 2H- isoindol- 2- yl)furan- 2- carboxamide
Smiles: Brc1ccc(o1)C(=O)NN1Cc2c(C1=N)cccc2

STK588649
Synonyms: N- (3- hydroxypropyl)- 10- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: OCCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CC(C)CC2

STK588652
Synonyms: N- [(2E)- 4- (4- fluorophenyl)- 1,3- thiazol- 2(3H)- ylidene]- 2- {[5- (2- methylfuran- 3- yl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}acetamide
Smiles: Fc1ccc(cc1)c1cs/c(=N/C(=O)CSc2nnc(o2)c2ccoc2C)/[nH]1

STK588653
Synonyms: 2- [(2,2- diethoxyethyl)sulfanyl]- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CCOC(CSc1nc(N)c2c(n1)sc1c2CC(OC1)(C)C)OCC

STK588654
Synonyms: 7'- {[(E)- (1- cyclohexyl- 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)C1CCCCC1

STK588655
Synonyms: (5Z)- 5- (1- hydroxyethylidene)- 1- (2- methylphenyl)- 3- phenyl- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: C/C(=C/1\C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccccc1C)/O

STK588656
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,5- dichlorophenyl)acetamide
Smiles: O=C(Nc1cc(Cl)cc(c1)Cl)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK588657
Synonyms: 8- [(4- benzylpiperidin- 1- yl)methyl]- 7- butyl- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCn1c(CN2CCC(CC2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK588659
Synonyms: 7- (2- chlorobenzyl)- 6- hydroxy- 3- methyl- 8- [4- (3- methylbutyl)piperazin- 1- yl]- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(CCN1CCN(CC1)c1nc2c(n1Cc1ccccc1Cl)c(O)nc(=O)n2C)C

STK588660
Synonyms: methylN- {[2- (trifluoromethyl)phenyl]carbamoyl}- D- methioninate
Smiles: CSCC[C@H](C(=O)OC)NC(=O)Nc1ccccc1C(F)(F)F

STK588661
Synonyms: 5- (4- chlorophenyl)- 10- (3- hydroxyphenyl)- 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)COC2c1cccc(c1)O)C

STK588662
Synonyms: (4E)- 5- (3- chlorophenyl)- 4- [furan- 2- yl(hydroxy)methylidene]- 1- [5- (methylsulfanyl)- 1,3,4- thiadiazol- 2- yl]pyrrolidine- 2,3- dione
Smiles: CSc1nnc(s1)N1C(c2cccc(c2)Cl)/C(=C(/c2ccco2)\O)/C(=O)C1=O

STK588664
Synonyms: 6- hydroxy- 7- [2- (4- methoxyphenyl)ethyl]- 8- [4- (4- methoxyphenyl)piperazin- 1- yl]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: COc1ccc(cc1)CCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)c1ccc(cc1)OC

STK588665
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C(F)(F)F)nnc1COc1ccc(cc1)Cl

STK588669
Synonyms: 7- ethyl- 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: CCc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccc(cc1)C(C)C)c1noc(c1)C

STK588671
Synonyms: 6- hydroxy- 8- [(2E)- 2- (2- hydroxy- 3- methoxybenzylidene)hydrazinyl]- 7- (2- hydroxy- 3- phenoxypropyl)- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: COc1cccc(c1O)/C=N/Nc1nc2c(n1CC(COc1ccccc1)O)c(O)nc(=O)n2C

STK588672
Synonyms: 4- ({(E)- [4- (benzyloxy)- 3- methoxyphenyl]methylidene}amino)- 5- (4- fluorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(ccc1OCc1ccccc1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)F

STK588674
Synonyms: 1- [2- (4- fluorophenyl)- 8- methyl- 10- phenyl- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- yl]ethanone
Smiles: Fc1ccc(cc1)c1nn2c(n1)c1c(nc2)OC(=C(C1c1ccccc1)C(=O)C)C

STK588676
Synonyms: (1'R,2'R)- 1'- {[4- (2- methylpropyl)phenyl]carbonyl}- 2'- phenyl- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: CC(Cc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccccc1)C(=O)c1c(C2=O)cccc1)C

STK588677
Synonyms: (5E)- 1- (3,4- dimethylphenyl)- 5- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/NCCCN1CCOCC1)c1ccc(c(c1)C)C

STK588679
Synonyms: (4E)- 1- (5- acetyl- 4- methyl- 1,3- thiazol- 2- yl)- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 5- [3- (pentyloxy)phenyl]pyrrolidine- 2,3- dione
Smiles: CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)C

STK588680
Synonyms: N- [(2E)- 3- (2- methoxybenzyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- phenoxyacetamide
Smiles: COc1ccccc1CN1/C(=N\C(=O)COc2ccccc2)/SC2C1CS(=O)(=O)C2

STK588681
Synonyms: 4- imino- 9,10- dimethoxy- 2- (3- nitrophenyl)- 6,7- dihydro- 4H- pyrido[2,1- a]isoquinoline- 3- carbonitrile
Smiles: COc1cc2CCn3c(c2cc1OC)cc(c(c3=N)C#N)c1cccc(c1)[N+](=O)[O-]

STK588682
Synonyms: 6'- chloro- 7'- [(1,3- dimethyl- 2,4,6- trioxotetrahydropyrimidin- 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)- trione
Smiles: CN1C(=O)N(C)C(=O)C(=Cc2ccc3c(c2Cl)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)C1=O

STK588683
Synonyms: ethyl2- [2- (9- methoxy- 6H- indolo[2,3- b]quinoxalin- 6- yl)ethoxy]benzoate
Smiles: CCOC(=O)c1ccccc1OCCn1c2ccc(cc2c2c1nc1ccccc1n2)OC

STK588684
Synonyms: 2- (6- oxo- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 7(6H)- yl)- N- (2- phenylethyl)acetamide
Smiles: O=C(Cn1c2ccccc2c2c1c(=O)n1CCCSc1n2)NCCc1ccccc1

STK588685
Synonyms: 3- (2,6- dichlorobenzyl)- 8- (2- methoxyethyl)- 1,7- dimethyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COCCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1c(Cl)cccc1Cl

STK588687
Synonyms: 3- [(3a'S,6a'R)- 5- fluoro- 5'- (4- fluorobenzyl)- 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)Cc1ccc(cc1)F)C(=O)Nc1c2cc(F)cc1

STK588688
Synonyms: (4Z)- 4- [(2,4- dimethylphenyl)imino]- 6- {[4- (2- fluorophenyl)piperazin- 1- yl]methyl}- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: Cc1ccc(c(c1)C)/N=c/1\nc(N)nc([nH]1)CN1CCN(CC1)c1ccccc1F

STK588689
Synonyms: methylN- [(5,7- dimethyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)carbonyl]glycinate
Smiles: COC(=O)CNC(=O)c1nn2c(n1)nc(cc2C)C

STK588690
Synonyms: (3Z)- 1- heptyl- 3- (4- hydroxy- 2- thioxo- 1,3- thiazol- 5(2H)- ylidene)- 1,3- dihydro- 2H- indol- 2- one
Smiles: CCCCCCCN1c2ccccc2/C(=C\2/SC(=S)N=C2O)/C1=O

STK588692
Synonyms: (2'S,3S,3'S,10b'R)- 3'- (phenylcarbonyl)- 2'- {[2- (prop- 2- en- 1- yloxy)phenyl]carbonyl}- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: C=CCOc1ccccc1C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK588693
Synonyms: N- (2- hydroxyethyl)- 10- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CC1Cc2c(CC1)sc1c2c2nc(nn2cn1)C(=O)NCCO

STK588694
Synonyms: N- (4- bromo- 2- methylphenyl)- 2- {[4- (4- methoxyphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C)Br)nnc1Cc1cccs1

STK588696
Synonyms: 1- methyl- 8- (4- phenoxyphenyl)- 3- (prop- 2- en- 1- yl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: C=CCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)Oc1ccccc1

STK588698
Synonyms: 4- {[(E)- (5- methylthiophen- 2- yl)methylidene]amino}- 5- (pyridin- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1ccc(s1)/C=N/n1c(=S)[nH]nc1c1ccccn1

STK588699
Synonyms: 3,6,6- trimethyl- 2- [(4- methylpiperazin- 1- yl)carbonyl]- 6,7- dihydro- 1- benzofuran- 4(5H)- one
Smiles: CN1CCN(CC1)C(=O)c1oc2c(c1C)C(=O)CC(C2)(C)C

STK588700
Synonyms: 7- chloro- 1- (2,5- dimethoxyphenyl)- 2- (4- methyl- 1,3- thiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(cc1C1N(c2scc(n2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl)OC

STK588701
Synonyms: N- (3,4- difluorophenyl)- 2- {[4- phenyl- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1c1ccccc1)c1ccccn1

STK588702
Synonyms: 6- methyl- 9- (pyridin- 3- ylmethyl)- 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)Cc1cccnc1

STK588703
Synonyms: 1- hydroxy- 5- methyl- 9- oxo- 9H- xanthen- 3- ylN- (tert- butoxycarbonyl)- D- methioninate
Smiles: CSCC[C@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C)NC(=O)OC(C)(C)C

STK588704
Synonyms: 6- (4- chlorophenyl)- 7- (4- fluorophenyl)- 10- (methylsulfanyl)- 7,11- dihydro- 6H- chromeno[4,3- d][1,2,4]triazolo[1,5- a]pyrimidine
Smiles: CSc1nn2c(=NC3=C(C2c2ccc(cc2)F)C(Oc2c3cccc2)c2ccc(cc2)Cl)[nH]1

STK588705
Synonyms: N- (3,5- dimethoxyphenyl)- 2- {[5- (2- fluorophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2c2ccccc2)c2ccccc2F)cc(c1)OC

STK588708
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,5- dimethylphenyl)acetamide
Smiles: COc1cccc(c1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1cc(C)ccc1C

STK588710
Synonyms: N- [(2E)- 3- (3- bromophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- methoxyacetamide
Smiles: COCC(=O)/N=C\1/SC2C(N1c1cccc(c1)Br)CS(=O)(=O)C2

STK588711
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- chlorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,4- dimethylphenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)C)C)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK588713
Synonyms: 6- (furan- 2- yl)- 9- phenyl- 2- (trifluoromethyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: OC1=C2C(=Nc3n(C2c2ccccc2)nc(n3)C(F)(F)F)CC(C1)c1ccco1

STK588714
Synonyms: N- (3- chloro- 2- methylphenyl)- 5- hydroxy- 7,7- dimethyl- 2- oxo- 2,3,4,6,7,8- hexahydroquinoline- 4- carboxamide
Smiles: O=C1N=C2CC(C)(C)CC(=C2C(C1)C(=O)Nc1cccc(c1C)Cl)O

STK588716
Synonyms: 2- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 6- {[(4- methylphenyl)sulfanyl]methyl}pyrimidin- 4- ol
Smiles: Oc1cc(CSc2ccc(cc2)C)nc(n1)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK588717
Synonyms: 2- [(3a'S,6a'R)- 5- bromo- 5'- tert- butyl- 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)C(C)(C)C)C(=O)Nc1c2cc(Br)cc1

STK588720
Synonyms: 8- [(2,5- dibromophenyl)sulfonyl]- 7- methyl- 3,4,7,8,9,10- hexahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline
Smiles: Brc1ccc(c(c1)S(=O)(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1)Br

STK588721
Synonyms: N'- [(E)- (4- ethoxy- 3- methoxyphenyl)methylidene]- 5- methoxy- 1H- indole- 2- carbohydrazide
Smiles: CCOc1ccc(cc1OC)/C=N/NC(=O)c1cc2c([nH]1)ccc(c2)OC

STK588722
Synonyms: 9- (2- chlorophenyl)- 6- phenyl- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: OC1=C2C(=Nc3n(C2c2ccccc2Cl)ncn3)CC(C1)c1ccccc1

STK588724
Synonyms: 3- [(5- tert- butyl- 2- methyl- 3- phenylpyrazolo[1,5- a]pyrimidin- 7- yl)sulfanyl]pentane- 2,4- dione
Smiles: CC(=O)C(C(=O)C)Sc1cc(nc2n1nc(c2c1ccccc1)C)C(C)(C)C

STK588725
Synonyms: 5- (4- ethoxyphenyl)- 4- {[(E)- (2,3,4- trimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(c(c1OC)OC)OC

STK588726
Synonyms: 4- (4- chlorophenyl)- 3- (3- methoxyphenyl)- 5- [(4- methylbenzyl)sulfanyl]- 4H- 1,2,4- triazole
Smiles: COc1cccc(c1)c1nnc(n1c1ccc(cc1)Cl)SCc1ccc(cc1)C

STK588730
Synonyms: (E)- {1- [3- (dimethylammonio)propyl]- 2- (4- ethylphenyl)- 4,5- dioxopyrrolidin- 3- ylidene}[4- (propan- 2- yloxy)phenyl]methanolate
Smiles: CCc1ccc(cc1)C1N(CCC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC(C)C)/[O-]

STK588732
Synonyms: 1- [1- (3- chlorophenyl)but- 3- en- 1- yl]- 1- [3- (morpholin- 4- yl)propyl]- 3- phenylurea
Smiles: C=CCC(N(C(=O)Nc1ccccc1)CCCN1CCOCC1)c1cccc(c1)Cl

STK588734
Synonyms: 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Cn1nnc2c(c1=O)cccc2)Nc1cccc(c1)C(F)(F)F

STK588735
Synonyms: 2- ({(E)- [2- (2,4- dimethylphenyl)- 1,3- dioxo- 2,3- dihydroisoquinolin- 4(1H)- ylidene]methyl}amino)benzoicacid
Smiles: Cc1ccc(c(c1)C)N1C(=O)/C(=C/Nc2ccccc2C(=O)O)/c2c(C1=O)cccc2

STK588736
Synonyms: (4E)- 1- (6- fluoro- 1,3- benzothiazol- 2- yl)- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 5- [3- (pentyloxy)phenyl]pyrrolidine- 2,3- dione
Smiles: CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)F

STK588737
Synonyms: 3- (4- chlorophenyl)- 2- [(2- methoxyethyl)amino]- 7- methyl- 5,6,7,8- tetrahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: COCCNc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Cl)CCN(C3)C

STK588739
Synonyms: 7- benzyl- 1,3- dimethyl- 8- [(4- methylpiperidin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC1CCN(CC1)Cc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

STK588740
Synonyms: 2- {11- [4- (dimethylamino)phenyl]- 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}phenol
Smiles: CN(c1ccc(cc1)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1ccccc1O)c1ccccc1)C

STK588741
Synonyms: N- [2- (dimethylamino)ethyl]- 10- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CN(CCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CC(C)CC2)C

STK588742
Synonyms: 2- {[5- (3- chlorophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,5- dichlorophenyl)acetamide
Smiles: O=C(Nc1cc(Cl)ccc1Cl)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK588743
Synonyms: N'- {(E)- [4- hydroxy- 1- (naphthalen- 1- yl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}pyridine- 4- carbohydrazide
Smiles: O=C1N=C(O)/C(=C\NNC(=O)c2ccncc2)/C(=O)N1c1cccc2c1cccc2

STK588745
Synonyms: 3- {[4- (3- bromophenyl)- 1,3- thiazol- 2- yl]amino}- 6,7- dimethoxy- 2- benzofuran- 1(3H)- one
Smiles: COc1c(OC)ccc2c1C(=O)OC2Nc1scc(n1)c1cccc(c1)Br

STK588746
Synonyms: N- {4- [(3E)- 3- [(4- chlorophenyl)(hydroxy)methylidene]- 2- (3- nitrophenyl)- 4,5- dioxopyrrolidin- 1- yl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1cccc(c1)[N+](=O)[O-]

STK588747
Synonyms: 3- (1,3- benzodioxol- 5- ylmethyl)- 6'- hydroxy- 8- nitro- 3'- (prop- 2- en- 1- yl)- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4'(3'H)- dione
Smiles: C=CCN1C(=O)N=C(C2(C1=O)Cc1cc(ccc1N1C2CN(CC1)Cc1ccc2c(c1)OCO2)[N+](=O)[O-])O

STK588750
Synonyms: N,N- dimethyl- 4- [10- 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]pyrimidin- 2- yl]aniline
Smiles: Cc1nn(c2c1C(c1cccnc1)c1c(O2)ncn2c1nc(n2)c1ccc(cc1)N(C)C)c1ccccc1

STK588751
Synonyms: 4- chloro- N- [(3Z)- 1- (2- methylpropyl)- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]benzenesulfonamide
Smiles: CC(Cn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)Cl)/c2c1nc1ccccc1c2)C

STK588753
Synonyms: ethyl[(2- methyl- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidin- 7- yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1nnc2n1c1sc3c(c1c1n2nc(n1)C)CCCC3

STK588754
Synonyms: N- [4- chloro- 3- (trifluoromethyl)phenyl]- 3- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanamide
Smiles: O=C(Nc1ccc(c(c1)C(F)(F)F)Cl)CCn1nnc2c(c1=O)cccc2

STK588756
Synonyms: 2- [4- (4- methylphenyl)- 5- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 4H- 1,2,4- triazol- 3- yl]pyridine
Smiles: Cc1ccc(cc1)n1c(SC/C=C/c2ccccc2)nnc1c1ccccn1

STK588757
Synonyms: (3S)- N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: O=C([C@H]1NCc2c(C1)cccc2)Nc1ccc2c(c1)OCCO2

STK588758
Synonyms: N- (pyridin- 2- ylmethyl)- 2,3- dihydro- 1H- cyclopenta[b]quinoline- 9- carboxamide
Smiles: O=C(c1c2CCCc2nc2c1cccc2)NCc1ccccn1

STK588761
Synonyms: 4- {[(1E,2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]amino}- 5- [3- (propan- 2- yloxy)phenyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/C=C/c1ccco1)C

STK588762
Synonyms: 5,7- dichloro- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- (4- nitrophenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccc(cc1)[N+](=O)[O-])c(=O)c1c(o2)c(Cl)cc(c1)Cl

STK588765
Synonyms: 2- {[5- (2- chlorophenyl)- 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)c1ccccc1Cl

STK588766
Synonyms: 4- hydroxy- 6- {[(4- methylphenyl)sulfanyl]methyl}- 2- phenyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]pyridin- 3- one
Smiles: Cc1ccc(cc1)SCc1cc(O)c2c(n1)[nH]n(c2=O)c1ccccc1

STK588768
Synonyms: (3S,3a'R,8a'S,8b'S)- 7- chloro- 2'- (2,4- dichlorophenyl)- 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: Clc1ccc(c(c1)Cl)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cccc2Cl

STK588769
Synonyms: N- (4- ethylphenyl)- 2- {[5- (3- methoxyphenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1cccc(c1)OC

STK588770
Synonyms: N- [(2Z)- 3- [2- (3,4- dimethoxyphenyl)ethyl]- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]acetamide
Smiles: COc1cc(CCN2/C(=N/C(=O)C)/SC3C2CS(=O)(=O)C3)ccc1OC

STK588771
Synonyms: 2- {[7,7- dimethyl- 2- (3- methylphenyl)- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}- 1- phenylethanone
Smiles: Cc1cccc(c1)c1nc(SCC(=O)c2ccccc2)c2c(n1)CC(OC2)(C)C

STK588774
Synonyms: N- (3- chloro- 4- fluorophenyl)- 2- {[5- (3- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK588775
Synonyms: 2- {[2,2- dimethyl- 5- (propan- 2- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8- yl](ethyl)amino}ethanol
Smiles: OCCN(c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C(C)C)CC

STK588776
Synonyms: 2- [(3- bromobenzyl)amino]- 5,6- dimethyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Brc1cccc(c1)CNc1nc2n(n1)c(O)c(c(n2)C)C

STK588777
Synonyms: 1- (2,5- dimethoxyphenyl)- 2- [6- (propan- 2- yl)- 1,3- benzothiazol- 2- yl]- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(c(c1)C1N(c2nc3c(s2)cc(cc3)C(C)C)C(=O)c2c1c(=O)c1c(o2)cccc1)OC

STK588781
Synonyms: methylN- [(2,4- dimethoxyphenyl)carbamoyl]- D- methioninate
Smiles: CSCC[C@H](C(=O)OC)NC(=O)Nc1ccc(cc1OC)OC

STK588782
Synonyms: (8S,8aR,11aS)- N- (1,3- benzodioxol- 5- yl)- 10- (4- methylphenyl)- 9,11- dioxo- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 8- carboxamide
Smiles: Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)Nc2ccc3c(c2)OCO3)C=Cc2c1cccc2

STK588783
Synonyms: methylN- [(3,4- dichlorophenyl)carbamoyl]- D- alaninate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccc(c(c1)Cl)Cl)C

STK588786
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- {[5- (3- chlorophenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1c1cccc(c1)Cl

STK588787
Synonyms: (2Z)- 2- (2- chloro- 6- fluorobenzylidene)- 6- (2- oxopropoxy)- 1- benzofuran- 3(2H)- one
Smiles: CC(=O)COc1ccc2c(c1)O/C(=C\c1c(F)cccc1Cl)/C2=O

STK588788
Synonyms: N- (2- methylphenyl)- 2- [(11- methyl- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidin- 7- yl)sulfanyl]acetamide
Smiles: CC1CCc2c(C1)sc1c2c2ncnn2c2n1c(SCC(=O)Nc1ccccc1C)nn2

STK588789
Synonyms: 2- amino- 4- (3- bromophenyl)- 5- hydroxy- 7- methyl- 4H- pyrano[3,2- c]pyridine- 3- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1)Br)c(O)nc(c2)C

STK588791
Synonyms: 2- ({[(3,4,8- trimethyl- 2- oxo- 2H- chromen- 7- yl)oxy]acetyl}amino)benzamide
Smiles: O=C(Nc1ccccc1C(=O)N)COc1ccc2c(c1C)oc(=O)c(c2C)C

STK588792
Synonyms: 4- ({(E)- [4- (methylsulfanyl)phenyl]methylidene}amino)- 5- (3,4,5- trimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)SC

STK588793
Synonyms: 3- (4- chlorophenyl)- 5,6,7,8- tetrahydropyrazolo[5,1- b]quinazolin- 9- ol
Smiles: Clc1ccc(cc1)c1cnn2c1nc1CCCCc1c2O

STK588794
Synonyms: 1- (2- bromophenyl)- 2- {[4- phenyl- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}ethanone
Smiles: O=C(c1ccccc1Br)CSc1nnc(n1c1ccccc1)c1ccccn1

STK588795
Synonyms: (6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)(2- fluorophenyl)methanone
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=O)c1ccccc1F

STK588796
Synonyms: N- [4- (diethylamino)phenyl]- 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(cc2)N(CC)CC)nnc1Cc1cccs1

STK588797
Synonyms: 3- (2- oxo- 2- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}ethyl)quinazolin- 4(3H)- one
Smiles: O=C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)Cn1cnc2c(c1=O)cccc2

STK588798
Synonyms: 3- (3,5- dimethylphenyl)- 10- methyl- 2- pentylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: CCCCCc1nc2c(c(=O)n1c1cc(C)cc(c1)C)c(=O)c1c(n2C)cccc1

STK588799
Synonyms: 7- (3- chlorobenzyl)- 6- hydroxy- 8- {[4- (4- methoxyphenyl)piperazin- 1- yl]methyl}- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1Cc1cccc(c1)Cl)c(O)nc(=O)n2C

STK588802
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,4- difluorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK588804
Synonyms: 3- (3- tert- butyl- 5- methyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)- N- (tetrahydrofuran- 2- ylmethyl)propanamide
Smiles: O=C(CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C(C)(C)C)NCC1CCCO1

STK588806
Synonyms: ethyl4- [(5- chloro- 1H- indol- 2- yl)carbonyl]piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)ccc(c2)Cl

STK588808
Synonyms: (5Z)- 5- [4- (dimethylamino)benzylidene]- 2- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}- 1,3- thiazol- 4(5H)- one
Smiles: O=C1N=C(S/C/1=C\c1ccc(cc1)N(C)C)N1CCN(CC1)c1cccc(c1)C(F)(F)F

STK588809
Synonyms: 7'- {(E)- [1- (3,5- 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: Cc1cc(C)cc(c1)N1C(=O)N=C(/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK588810
Synonyms: 2- (6- chloro- 7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- [3- (2- oxopyrrolidin- 1- yl)propyl]acetamide
Smiles: COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)NCCCN1CCCC1=O

STK588811
Synonyms: 5- {4- [(4- methylbenzyl)oxy]phenyl}- N'- {(E)- [4- (propan- 2- yl)phenyl]methylidene}- 1H- pyrazole- 3- carbohydrazide
Smiles: Cc1ccc(cc1)COc1ccc(cc1)c1[nH]nc(c1)C(=O)N/N=C/c1ccc(cc1)C(C)C

STK588818
Synonyms: 2- (5- methoxy- 4,7- dimethyl- 2- oxo- 2H- chromen- 3- yl)- N- (2- methoxyethyl)acetamide
Smiles: COCCNC(=O)Cc1c(=O)oc2c(c1C)c(OC)cc(c2)C

STK588819
Synonyms: 6- [(1,3- benzothiazol- 2- ylsulfanyl)methyl]- 2- [4- (3- methoxyphenyl)piperazin- 1- yl]pyrimidin- 4- ol
Smiles: COc1cccc(c1)N1CCN(CC1)c1nc(O)cc(n1)CSc1nc2c(s1)cccc2

STK588820
Synonyms: N,N- diethyl- N'- (5- propyl- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinolin- 8- yl)ethane- 1,2- diamine
Smiles: CCCc1nc2oc3c(c2c2c1CCCC2)ncnc3NCCN(CC)CC

STK588821
Synonyms: (1'S,3R,3'S,7a'S)- 5''- 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)Nc1c2cc(Cl)cc1C

STK588822
Synonyms: 3- ethyl- 8- ({(Z)- [4- hydroxy- 2,6- dioxo- 1- (propan- 2- yl)- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}amino)- 1',3'- dimethyl- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4'
Smiles: CCN1CCN2C(C1)C1(Cc3c2ccc(c3)N/C=C\2/C(=NC(=O)N(C2=O)C(C)C)O)C(=O)N(C)C(=O)N(C1=O)C

STK588823
Synonyms: methyl[8- (2,4- dimethoxyphenyl)- 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(cc1OC)OC

STK588824
Synonyms: 4- hydroxy- 1- methyl- 8- (3- methylphenyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purin- 2(6H)- one
Smiles: Cc1cccc(c1)N1CCn2c1nc1c2c(O)nc(=O)n1C

STK588825
Synonyms: 10- (4- hydroxyphenyl)- 1,3,7,7- tetramethyl- 5- (3- nitrophenyl)- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: Oc1ccc(cc1)C1OCC(n2c1c1n(C)c(=O)n(c(=O)c1c2c1cccc(c1)[N+](=O)[O-])C)(C)C

STK588826
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(4- methoxyphenyl)carbonyl]- 2'- {[3- (prop- 2- en- 1- yloxy)phenyl]carbonyl}- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: C=CCOc1cccc(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)OC)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK588827
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)- 3- (3- nitrophenyl)- 6- [3- (trifluoromethyl)phenyl]- 4a,7a,8,8a- tetrahydro- 3aH- 4,8- methano[1,2]oxazolo[4,5- f]isoindole- 5,7(4H,6H)- dione
Smiles: O=C1N(c2cccc(c2)C(F)(F)F)C(=O)[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1ON=C2c1cccc(c1)[N+](=O)[O-]

STK588828
Synonyms: 2- {[4- (4- methoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [2- (trifluoromethyl)phenyl]acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(F)(F)F)nnc1COc1ccccc1

STK588829
Synonyms: 3- (2- chlorobenzyl)- 1- methyl- 8- (2- methylphenyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: Clc1ccccc1Cn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1C

STK588830
Synonyms: N- [(2Z)- 3- benzyl- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]cyclopropanecarboxamide
Smiles: O=C(C1CC1)/N=C/1\SC2C(N1Cc1ccccc1)CS(=O)(=O)C2

STK588831
Synonyms: methylN- {[4- (acetylamino)phenyl]carbamoyl}- L- alaninate
Smiles: COC(=O)[C@@H](NC(=O)Nc1ccc(cc1)NC(=O)C)C

STK588832
Synonyms: 6- [(1,3- benzothiazol- 2- ylsulfanyl)methyl]- 4- hydroxy- 2- phenyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]pyridin- 3- one
Smiles: Oc1cc(CSc2nc3c(s2)cccc3)nc2c1c(=O)n([nH]2)c1ccccc1

STK588835
Synonyms: 3- (4- chlorophenyl)- 5- [(2E)- 3- (2,4- dimethoxyphenyl)prop- 2- enoyl]- 2,6- dihydroxypyrimidin- 4(3H)- one
Smiles: COc1cc(OC)ccc1/C=C/C(=O)c1c(O)nc(n(c1=O)c1ccc(cc1)Cl)O

STK588836
Synonyms: (5Z)- 5- [(5- bromothiophen- 2- yl)methylidene]- 3- (2- fluorobenzyl)- 2- hydroxy- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: Brc1ccc(s1)/C=C/1\N=C(N(C1=O)Cc1ccccc1F)O

STK588837
Synonyms: N- [(2Z)- 1,3- benzothiazol- 2(3H)- ylidene]- 5- (propan- 2- yl)- 1,4,5,6- tetrahydro- 1,3,5- triazin- 2- amine
Smiles: CC(N1CNC(=NC1)/N=c/1\sc2c([nH]1)cccc2)C

STK588838
Synonyms: (4E)- 4- [(4- chlorophenyl)(hydroxy)methylidene]- 1,5- diphenylpyrrolidine- 2,3- dione
Smiles: Clc1ccc(cc1)/C(=C\1/C(c2ccccc2)N(C(=O)C1=O)c1ccccc1)/O

STK588839
Synonyms: 4- [(2- ethoxyethyl)sulfanyl]- 2- (3- methoxyphenyl)- 7,7- dimethyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidine
Smiles: CCOCCSc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)OC

STK588840
Synonyms: 2- (furan- 2- yl)- 3- (3- methoxypropyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COCCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1ccco1

STK588841
Synonyms: N- {1- [2- (2- methoxyphenyl)ethyl]- 5- oxo- 2- phenyl- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl}acetamide
Smiles: COc1ccccc1CCN1C(=NC(C1=O)(NC(=O)C)C(F)(F)F)c1ccccc1

STK588842
Synonyms: 3- [(3a'S,6a'R)- 6- chloro- 5'- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 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)c1ccc3c(c1)OCCO3)C(=O)Nc1c2ccc(c1C)Cl

STK588844
Synonyms: N- (naphthalen- 1- yl)- 2- {[4- phenyl- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc(n1c1ccccc1)c1ccccn1

STK588845
Synonyms: 2- (2- chlorobenzyl)- 1- (3,4- dimethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(cc1OC)C1N(Cc2ccccc2Cl)C(=O)c2c1c(=O)c1c(o2)cccc1

STK588846
Synonyms: 8- (3- chlorophenyl)- 2- (3,4- dimethoxybenzyl)- 10- methyl- 11- (pyridin- 3- yl)- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1cc(ccc1OC)Cc1nn2c(n1)c1c(nc2)Oc2c(C1c1cccnc1)c(C)nn2c1cccc(c1)Cl

STK588849
Synonyms: 1,3- dimethyl- 8- [(4- methylpiperazin- 1- yl)methyl]- 7- (2- methylpropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(Cn1c(CN2CCN(CC2)C)nc2c1c(=O)n(c(=O)n2C)C)C

STK588850
Synonyms: 4- [({4- (4- methoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)methyl]benzonitrile
Smiles: COc1ccc(cc1)n1c(nnc1COc1ccc(cc1)C)SCc1ccc(cc1)C#N

STK588852
Synonyms: 3- [(4- chlorophenoxy)methyl]- 5- [(4- fluorobenzyl)sulfanyl]- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazole
Smiles: COc1ccc(cc1)n1c(COc2ccc(cc2)Cl)nnc1SCc1ccc(cc1)F

STK588854
Synonyms: 4- {[(E)- naphthalen- 1- ylmethylidene]amino}- 5- [3- (propan- 2- yloxy)phenyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cccc2c1cccc2)C

STK588855
Synonyms: 3- (2- chlorophenyl)- 5- [(2- methylbenzyl)sulfanyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazole
Smiles: Cc1ccc(cc1)n1c(SCc2ccccc2C)nnc1c1ccccc1Cl

STK588856
Synonyms: propyl[(4- chlorophenyl)(phenylamino)methyl][4- (dimethylamino)phenyl]phosphinate
Smiles: CCCOP(=O)(C(c1ccc(cc1)Cl)Nc1ccccc1)c1ccc(cc1)N(C)C

STK588859
Synonyms: N- (3,4- dimethoxyphenyl)- 2- {[4- (4- methoxyphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)OC)OC)nnc1Cc1cccs1

STK588860
Synonyms: 3- (3- chlorophenyl)- 2- (diethylamino)- 7- methyl- 5,6,7,8- tetrahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: CCN(c1nc2sc3c(c2c(=O)n1c1cccc(c1)Cl)CCN(C3)C)CC

STK588862
Synonyms: N- [(2Z)- 3- (3- methoxyphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- phenoxyacetamide
Smiles: COc1cccc(c1)N1/C(=N/C(=O)COc2ccccc2)/SC2C1CS(=O)(=O)C2

STK588864
Synonyms: (4E)- 4- [(1- {2- hydroxy- 3- [(2- methoxyphenyl)amino]propyl}- 1H- indol- 3- yl)methylidene]- 5- methyl- 2- phenyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccccc1NCC(Cn1cc(c2c1cccc2)/C=C/1\C(=NN(C1=O)c1ccccc1)C)O

STK588866
Synonyms: 2- chloro- N- [4- (4- methoxyphenyl)- 6- methyl- 2- (4- methylphenyl)- 5- oxo- 2,5- dihydropyridazin- 3- yl]benzamide
Smiles: COc1ccc(cc1)c1c(NC(=O)c2ccccc2Cl)n(nc(c1=O)C)c1ccc(cc1)C

STK588871
Synonyms: {4- [7- (2,6- dimethylphenyl)- 6,8- dioxo- 1- oxa- 2,7- diazaspiro[4.4]non- 2- en- 3- yl]- 2- methoxyphenoxy}acetonitrile
Smiles: N#CCOc1ccc(cc1OC)C1=NOC2(C1)CC(=O)N(C2=O)c1c(C)cccc1C

STK588873
Synonyms: 5- methyl- 2- (pyridin- 3- yl)[1,2,4]triazolo[1,5- a]pyrimidin- 7(3H)- one
Smiles: Cc1cc(=O)n2c(n1)[nH]c(n2)c1cccnc1

STK588874
Synonyms: N- [(2E)- 1,3- benzothiazol- 2(3H)- ylidene]- 4- [(4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)methyl]cyclohexanecarboxamide
Smiles: O=C(C1CCC(CC1)Cn1nnc2c(c1=O)cccc2)/N=c\1/sc2c([nH]1)cccc2

STK588875
Synonyms: 8- ethoxy- N- (2- methoxyethyl)- 5H- pyrimido[5,4- b]indol- 4- amine
Smiles: COCCNc1ncnc2c1[nH]c1c2cc(cc1)OCC

STK588876
Synonyms: 6,7- dimethyl- 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)C)C

STK588877
Synonyms: N- [5- (acetylamino)- 2- methoxyphenyl]- 2- {[4- (furan- 2- ylmethyl)- 5- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(n1Cc1ccco1)c1ccccc1)NC(=O)C

STK588880
Synonyms: (1'R,2'S)- 2'- (2- fluorophenyl)- 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]1c1ccccc1F)C(=O)c1c(C2=O)cccc1

STK588881
Synonyms: 2- ({5- [(4- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}sulfanyl)- N- [2- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1nnc(s1)SCc1ccc(cc1)Cl

STK588882
Synonyms: 9- (5- methyl- 1,2- oxazol- 3- yl)- 8- [3- (propan- 2- yloxy)phenyl]- 8,9- dihydrobenzo[7,8]chromeno[2,3- c]pyrrole- 7,10- dione
Smiles: CC(Oc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c2ccccc2cc1)C

STK588884
Synonyms: 4- {[(E)- furan- 2- ylmethylidene]amino}- 5- (2- methoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccco1

STK588886
Synonyms: (5Z)- 3- benzyl- 6- hydroxy- 5- {[1- (2- hydroxyphenyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]methylidene}pyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C/c2cc(n(c2C)c2ccccc2O)C)/C(=O)N1Cc1ccccc1

STK588887
Synonyms: ethyl4- [3- (4- fluorobenzyl)- 1- methyl- 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)Cc1ccc(cc1)F

STK588888
Synonyms: 3- {(Z)- [3- (furan- 2- ylmethyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 9- methyl- 2- (4- phenylpiperazin- 1- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: S=C1S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccccc2)/C(=O)N1Cc1ccco1

STK588889
Synonyms: 2- ethyl- 3- [2- (4- methoxyphenyl)ethyl]- 10- methylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: CCc1nc2c(c(=O)n1CCc1ccc(cc1)OC)c(=O)c1c(n2C)cccc1

STK588890
Synonyms: (1S)- 1- [5- (benzylsulfonyl)- 1,3,4- oxadiazol- 2- yl]- 2- phenylethanamine
Smiles: N[C@H](c1nnc(o1)S(=O)(=O)Cc1ccccc1)Cc1ccccc1

STK588892
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 5- (3,4- dimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1OC)c1n[nH]c(=S)n1c1ccc2c(c1)OCCO2

STK588893
Synonyms: 3- [(2,6- dichlorobenzyl)sulfanyl]- 5- [5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 4- amine
Smiles: Fc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCc1c(Cl)cccc1Cl

STK588896
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- ethyl- 6- methylphenyl)acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl)C

STK588898
Synonyms: 4- amino- 7'- methyl- 2'- oxo- 1',2',6,7- tetrahydrospiro[1,3- dioxolo[4,5- g]pyrido[2,1- a]isoquinoline- 2,3'- indole]- 3- carbonitrile
Smiles: N#CC1=C(N)N2CCc3c(C2=CC21C(=O)Nc1c2cccc1C)cc1c(c3)OCO1

STK588899
Synonyms: 6- methyl- 2- [(2- methylphenyl)amino]- 5- pentylpyrimidin- 4- ol
Smiles: CCCCCc1c(C)nc(nc1O)Nc1ccccc1C

STK588900
Synonyms: 3- (3- tert- butyl- 5- methyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)- N- (pyridin- 3- ylmethyl)propanamide
Smiles: O=C(NCc1cccnc1)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C(C)(C)C

STK588901
Synonyms: (2E)- 5- (2- nitrobenzyl)- 2- [(2E)- (3- nitrobenzylidene)hydrazinylidene]- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: OC1=N/C(=N\N=C\c2cccc(c2)[N+](=O)[O-])/SC1Cc1ccccc1[N+](=O)[O-]

STK588902
Synonyms: (2Z)- 7- {[benzyl(methyl)ammonio]methyl}- 2- (4- nitrobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: C[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccc(cc1)[N+](=O)[O-])/C2=O)Cc1ccccc1

STK588903
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 2- {[5- (3- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1Cl)NC(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK588904
Synonyms: 5- (2- chlorophenyl)- 4- ({(E)- [4- (trifluoromethyl)phenyl]methylidene}amino)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(F)(F)F

STK588906
Synonyms: (1S,2S)- N'- {(E)- [1- (2- chlorobenzyl)- 1H- indol- 3- yl]methylidene}- 2- phenylcyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1cn(c2c1cccc2)Cc1ccccc1Cl

STK588907
Synonyms: 2- (2- chlorophenyl)- 3- (furan- 2- ylmethyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: Clc1ccccc1c1nc2oc3ccccc3c(=O)c2c(=O)n1Cc1ccco1

STK588908
Synonyms: 5- (3- ethoxyphenyl)- 4- {[(E)- (5- methylthiophen- 2- yl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(s1)C

STK588909
Synonyms: N- (3- hydroxypropyl)- 2- [(3- methyl- 6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 1- yl)oxy]acetamide
Smiles: OCCCNC(=O)COc1cc(C)cc2c1c1CCCCc1c(=O)o2

STK588911
Synonyms: N- (3,5- dichlorophenyl)- 2- ({4- (4- ethoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cc(Cl)cc(c2)Cl)nnc1COc1ccc(cc1)C

STK588912
Synonyms: 5- {[(2Z)- 3- (3- chloro- 4- fluorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]amino}- 5- oxopentanoicacid
Smiles: OC(=O)CCCC(=O)/N=C/1\SC2C(N1c1ccc(c(c1)Cl)F)CS(=O)(=O)C2

STK588913
Synonyms: (5E)- 1- (4- chlorophenyl)- 5- ({[2- (morpholin- 4- yl)ethyl]amino}methylidene)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: Clc1ccc(cc1)N1C(=NC(=O)/C(=C\NCCN2CCOCC2)/C1=O)S

STK588914
Synonyms: 3- [(3- chlorobenzyl)sulfanyl]- 4- (4- chlorophenyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazole
Smiles: COc1cccc(c1)c1nnc(n1c1ccc(cc1)Cl)SCc1cccc(c1)Cl

STK588915
Synonyms: 5- (3- ethoxyphenyl)- 4- ({(E)- [4- (propan- 2- yl)phenyl]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(C)C

STK588916
Synonyms: (4E)- 1- hexadecyl- 4- [hydroxy(4- methylphenyl)methylidene]- 5- phenylpyrrolidine- 2,3- dione
Smiles: CCCCCCCCCCCCCCCCN1C(c2ccccc2)/C(=C(/c2ccc(cc2)C)\O)/C(=O)C1=O

STK588917
Synonyms: 2- [(4- chlorobenzyl)amino]- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 7(3H)- one
Smiles: Clc1ccc(cc1)CNc1nn2c([nH]1)nc(cc2=O)C

STK588918
Synonyms: N- (3- carbamoyl- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl)- 3- chloro- 7- nitro- 1- benzothiophene- 2- carboxamide
Smiles: O=C(c1sc2c(c1Cl)cccc2[N+](=O)[O-])Nc1sc2c(c1C(=O)N)CCC2

STK588919
Synonyms: 4- {(2E)- 2- [(8- hydroxy- 2,3,6,7- tetrahydro- 1H,5H- pyrido[3,2,1- ij]quinolin- 9- yl)methylidene]hydrazinyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)N/N=C/c1cc2CCCN3c2c(c1O)CCC3

STK588920
Synonyms: 3- [(2- methyl[1]benzofuro[3,2- d]pyrimidin- 4- yl)ammonio]benzoate
Smiles: Cc1nc([NH2+]c2cccc(c2)C(=O)[O-])c2c(n1)c1ccccc1o2

STK588921
Synonyms: 2- amino- 6- phenyl- 4- (2,3,4- trimethoxyphenyl)- 4H- pyran- 3,5- dicarbonitrile
Smiles: N#CC1=C(N)OC(=C(C1c1ccc(c(c1OC)OC)OC)C#N)c1ccccc1

STK588923
Synonyms: 4- [(1Z)- 2- cyano- 3- methoxy- 3- oxoprop- 1- en- 1- yl]- 2- methoxyphenyl3,4,5- trimethoxybenzoate
Smiles: COC(=O)/C(=C\c1ccc(c(c1)OC)OC(=O)c1cc(OC)c(c(c1)OC)OC)/C#N

STK588924
Synonyms: 5- (2- hydroxy- 5- methylphenyl)- N- (4- methylbenzyl)- 1H- pyrazole- 3- carboxamide
Smiles: Cc1ccc(cc1)CNC(=O)c1n[nH]c(c1)c1cc(C)ccc1O

STK588927
Synonyms: 2- ({4- (4- ethoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N,N- diethylacetamide
Smiles: CCOc1ccc(cc1)n1c(COc2ccc(cc2)C)nnc1SCC(=O)N(CC)CC

STK588929
Synonyms: N- (2,4- dimethylphenyl)- 3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline- 8(7H)- carbothioamide
Smiles: Cc1ccc(c(c1)C)NC(=S)N1CCc2c(C1)cc1c(c2)OCCCO1

STK588931
Synonyms: 8- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 7- (2- phenylethyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1CCc1ccccc1)c(=O)n(c(=O)n2C)C

STK588932
Synonyms: (4Z)- 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylimino)- 6- {[4- (2- fluorophenyl)piperazin- 1- yl]methyl}- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: Nc1nc(CN2CCN(CC2)c2ccccc2F)[nH]/c(=N/c2ccc3c(c2)OCCO3)/n1

STK588934
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 2,2- dimethyl- 5- (propan- 2- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8- amine
Smiles: COc1cc(CCNc2ncnc3c2oc2c3c3CC(C)(C)OCc3c(n2)C(C)C)ccc1OC

STK588935
Synonyms: (5E)- 5- ({[3- (dimethylamino)propyl]amino}methylidene)- 6- hydroxy- 3- [4- (propan- 2- yl)phenyl]pyrimidine- 2,4(3H,5H)- dione
Smiles: CN(CCCN/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)C(C)C)O)C

STK588937
Synonyms: N- (3- 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)Nc2cccc(c2)Br)nnc1COc1ccc(cc1)C

STK588941
Synonyms: (5Z)- 5- [5- (1,3- benzodioxol- 5- yl)pyrazolidin- 3- ylidene]- 3- (4- chlorophenyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C\2/NNC(C2)c2ccc3c(c2)OCO3)/C1=O)O

STK588942
Synonyms: 3- (3- tert- butyl- 5,9- dimethyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)- N- (3- methoxypropyl)propanamide
Smiles: COCCCNC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C

STK588943
Synonyms: 3- (furan- 2- yl)- 12- (pyridin- 3- yl)- 2,3,4,12- tetrahydrobenzimidazo[2,1- b]quinazolin- 1- ol
Smiles: OC1=C2C(=Nc3n(C2c2cccnc2)c2ccccc2n3)CC(C1)c1ccco1

STK588945
Synonyms: 4- {[4- (2- methoxyphenyl)piperazin- 1- ium- 1- yl]methyl}- 2- oxo- 2H- chromen- 6- olate
Smiles: COc1ccccc1N1CC[NH+](CC1)Cc1cc(=O)oc2c1cc([O-])cc2

STK588947
Synonyms: 6- (2- hydroxyphenyl)- 9- (3- methoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1cccc(c1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1O

STK588948
Synonyms: (3- chloro- 1- benzothiophen- 2- yl)(6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1sc2c(c1Cl)cccc2

STK588949
Synonyms: 4- ({4- chloro- N- [3- (3,5,9- trimethyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)propanoyl]phenylalanyl}amino)butanoicacid
Smiles: O=C(NC(C(=O)NCCCC(=O)O)Cc1ccc(cc1)Cl)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C

STK588950
Synonyms: 5- [(2E)- 3- (1,3- benzodioxol- 5- yl)prop- 2- enoyl]- 3- [2- (cyclohex- 1- en- 1- yl)ethyl]- 2,6- dihydroxypyrimidin- 4(3H)- one
Smiles: O=C(c1c(O)nc(n(c1=O)CCC1=CCCCC1)O)/C=C/c1ccc2c(c1)OCO2

STK588952
Synonyms: 3- (3- chlorophenyl)- 5- [(2,6- dichlorobenzyl)sulfanyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazole
Smiles: C=CCn1c(nnc1c1cccc(c1)Cl)SCc1c(Cl)cccc1Cl

STK588953
Synonyms: 4- {[(E)- (5- bromothiophen- 2- yl)methylidene]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(s1)Br

STK588955
Synonyms: 5- (3- methoxyphenyl)- 4- {[(E)- (5- methylthiophen- 2- yl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(s1)C

STK588956
Synonyms: 6- amino- 3- (3- ethoxyphenyl)- 4- (thiophen- 2- yl)- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: CCOc1cccc(c1)c1[nH]nc2c1C(c1cccs1)C(=C(O2)N)C#N

STK588957
Synonyms: N- (2- bromo- 4- methylphenyl)- 2- {[5- (2- fluorophenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2Br)C)nnc1c1ccccc1F

STK588958
Synonyms: 2,2- dimethyl- 5- (2- methylpropyl)- N- [3- (morpholin- 4- yl)propyl]- 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)ncnc3NCCCN1CCOCC1)C

STK588960
Synonyms: (4E)- 5- (3,4- dichlorophenyl)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 1- (1,3- thiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C(N1c1nccs1)c1ccc(c(c1)Cl)Cl

STK588962
Synonyms: 1- {[3- (2,4- dichlorophenyl)- 4,5- dihydro- 1,2- oxazol- 5- yl]methyl}- 3,7- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Clc1ccc(c(c1)Cl)C1=NOC(C1)Cn1c(=O)c2n(C)cnc2n(c1=O)C

STK588963
Synonyms: 2- (9- fluoro- 5- oxo- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 6(5H)- yl)- N- (3- methoxypropyl)acetamide
Smiles: COCCCNC(=O)Cn1c2ccc(cc2c2c1c(=O)n1CCSc1n2)F

STK588964
Synonyms: (E)- {1- [4- (dimethylammonio)phenyl]- 2- (3- nitrophenyl)- 4,5- dioxopyrrolidin- 3- ylidene}(phenyl)methanolate
Smiles: [O-]/C(=C\1/C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1ccc(cc1)[NH+](C)C)/c1ccccc1

STK588966
Synonyms: (4Z)- 2- (5- chloro- 2- methoxyphenyl)- 4- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc(cc1N1C(=O)/C(=C\NCCCN2CCOCC2)/c2c(C1=O)cccc2)Cl

STK588967
Synonyms: (4E)- 2- (2,5- dimethylphenyl)- 4- ({[(1- ethylpyrrolidin- 2- yl)methyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: CCN1CCCC1CN/C=C/1\c2ccccc2C(=O)N(C1=O)c1cc(C)ccc1C

STK588969
Synonyms: 6- hydroxy- 7- [2- hydroxy- 3- (4- methylphenoxy)propyl]- 3- methyl- 8- {[3- (propan- 2- yloxy)propyl]amino}- 3,7- dihydro- 2H- purin- 2- one
Smiles: OC(Cn1c(NCCCOC(C)C)nc2c1c(O)nc(=O)n2C)COc1ccc(cc1)C

STK588970
Synonyms: N- [2- (diethylamino)ethyl]- 5,10- dimethyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CCN(CCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CC(C)CC2)CC

STK588971
Synonyms: N- (2- ethyl- 6- methylphenyl)- 2- {[5- (3- methylphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C)C

STK588974
Synonyms: 2- (4- chlorophenyl)- 3- [6- (2,3- dichlorophenoxy)hexyl]quinazolin- 4(3H)- one
Smiles: Clc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCCCOc1cccc(c1Cl)Cl

STK588975
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 3,4,5,6- tetrahydrobenzo[h]quinazoline- 2- thiol
Smiles: SC1=NC2=C(C(N1)c1ccc3c(c1)OCO3)CCc1c2cccc1

STK588976
Synonyms: (3S,3a'S,6a'R)- 5'- (naphthalen- 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: O=C1N(c2cccc3c2cccc3)C(=O)[C@@H]2[C@H]1CN[C@]12C(=O)Nc2c1cccc2

STK588979
Synonyms: 8- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 7- (4- methylbenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1ccc(cc1)Cn1c(CN2CCN(CC2)c2ccc(cc2)F)nc2c1c(=O)n(c(=O)n2C)C

STK588980
Synonyms: 8- (4- benzylpiperidin- 1- yl)- 6- hydroxy- 3- methyl- 7- (4- methylbenzyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: Cc1ccc(cc1)Cn1c(nc2c1c(O)nc(=O)n2C)N1CCC(CC1)Cc1ccccc1

STK588981
Synonyms: 9- (3,5- dichlorophenyl)- 6- methyl- 2,3,9,10- tetrahydro- 8H- cyclopenta[3,4]chromeno[6,7- e][1,3]oxazin- 4(1H)- one
Smiles: Clc1cc(Cl)cc(c1)N1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCC2

STK588982
Synonyms: (E)- {2- (4- bromophenyl)- 1- [4- (dimethylammonio)phenyl]- 4,5- dioxopyrrolidin- 3- ylidene}(phenyl)methanolate
Smiles: Brc1ccc(cc1)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1c1ccc(cc1)[NH+](C)C

STK588983
Synonyms: (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)(5- nitrothiophen- 2- yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1ccc(s1)[N+](=O)[O-]

STK588987
Synonyms: 3- [(Z)- (4- oxo- 3- propyl- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 2- (4- phenylpiperazin- 1- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2)/C1=O

STK588988
Synonyms: 3- (2,4- dimethoxyphenyl)- 3,4,8,9- tetrahydro- 2H- cyclopenta[3,4]chromeno[8,7- e][1,3]oxazin- 6(7H)- one
Smiles: COc1cc(OC)ccc1N1COc2c(C1)c1oc(=O)c3c(c1cc2)CCC3

STK588989
Synonyms: 1- (3- fluorophenyl)- 2- (6- methylpyridin- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Fc1cccc(c1)C1N(c2cccc(n2)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK588991
Synonyms: 3- chloro- N- [(2Z)- 3- [(1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)amino]quinoxalin- 2(1H)- ylidene]benzenesulfonamide
Smiles: Clc1cccc(c1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1c(=O)n(n(c1C)C)c1ccccc1

STK588992
Synonyms: 8- {[4- (5- chloro- 2- methylphenyl)piperazin- 1- yl]methyl}- 7- (3- hydroxypropyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCCCn1c(CN2CCN(CC2)c2cc(Cl)ccc2C)nc2c1c(=O)n(c(=O)n2C)C

STK588996
Synonyms: 2- {[5- (5- aminopentyl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}- 1- (4- chlorophenyl)ethanone
Smiles: NCCCCCc1nnc(o1)SCC(=O)c1ccc(cc1)Cl

STK588997
Synonyms: 10a- [(E)- 2- {4- [(3- chlorobenzyl)oxy]- 3- methoxyphenyl}ethenyl]- 8,10,10- trimethyl- 3,4,10,10a- tetrahydropyrimido[1,2- a]indol- 2(1H)- one
Smiles: COc1cc(ccc1OCc1cccc(c1)Cl)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cc(cc1)C

STK588998
Synonyms: N- (3- fluoro- 4- methylphenyl)- 2- {[5- (4- fluorophenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)F)C)nnc1c1ccc(cc1)F

STK588999
Synonyms: 2- {[4- (furan- 2- ylmethyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- methoxy- 5- methylphenyl)acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C)C

STK589000
Synonyms: 2- [(2,4- dichlorophenyl)amino]- 6- methyl- 5- pentylpyrimidin- 4- ol
Smiles: CCCCCc1c(C)nc(nc1O)Nc1ccc(cc1Cl)Cl

STK589002
Synonyms: 1- tert- butyl4- (4- methyl- 2- oxo- 2H- chromen- 7- yl)piperidine- 1,4- dicarboxylate
Smiles: O=C(C1CCN(CC1)C(=O)OC(C)(C)C)Oc1ccc2c(c1)oc(=O)cc2C

STK589005
Synonyms: (3aR,4R,7S,7aR)- 3- [4- (benzyloxy)- 3- methoxyphenyl]- 3a,4,5,6,7,7a- hexahydro- 4,7- methano- 1,2- benzoxazole
Smiles: COc1cc(ccc1OCc1ccccc1)C1=NO[C@H]2[C@@H]1[C@H]1CC[C@@H]2C1

STK589007
Synonyms: 5- [(5- chloro- 2- methoxybenzyl)amino]- 2- (morpholin- 4- ium- 4- yl)benzoate
Smiles: COc1ccc(cc1CNc1ccc(c(c1)C(=O)[O-])[NH+]1CCOCC1)Cl

STK589009
Synonyms: (3a'S,6a'R)- 5'- tert- butyl- 3'- (4- hydroxybenzyl)- 5- 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: Oc1ccc(cc1)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cc(C)cc1

STK589010
Synonyms: N- (3- hydroxypropyl)- N'- {[4- (4- methoxyphenyl)tetrahydro- 2H- pyran- 4- yl]methyl}ethanediamide
Smiles: OCCCNC(=O)C(=O)NCC1(CCOCC1)c1ccc(cc1)OC

STK589011
Synonyms: 2- [(3- benzyl- 4,8- dimethyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- [3- (1H- imidazol- 1- yl)propyl]acetamide
Smiles: O=C(COc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1)NCCCn1cncc1

STK589012
Synonyms: (4E)- 5- (4- tert- butylphenyl)- 1- (furan- 2- ylmethyl)- 4- [hydroxy(3- nitrophenyl)methylidene]pyrrolidine- 2,3- dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)Cc1ccco1)/c1cccc(c1)[N+](=O)[O-]

STK589013
Synonyms: ethyl(2Z)- 2- {(2E)- [4- (dimethylamino)benzylidene]hydrazinylidene}- 4- methyl- 2,3- dihydro- 1,3- thiazole- 5- carboxylate
Smiles: CCOC(=O)c1s/c(=N\N=C\c2ccc(cc2)N(C)C)/[nH]c1C

STK589018
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- (4- fluorophenyl)- 1- (5- methyl- 1,3,4- thiadiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: Fc1ccc(cc1)C1N(c2nnc(s2)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK589019
Synonyms: 3- [2- (3,4- dimethoxyphenyl)ethyl]- 4- imino- 5- (4- methoxyphenyl)- 8,8- dimethyl- 3,4,5,7,8,9- hexahydro- 6H- chromeno[2,3- d]pyrimidin- 6- one
Smiles: COc1ccc(cc1)C1C2=C(Oc3c1c(=N)n(cn3)CCc1ccc(c(c1)OC)OC)CC(CC2=O)(C)C

STK589020
Synonyms: 10- (3- chlorophenyl)- 9- hydroxy- 7,7- dimethyl- 6,7,8,10- tetrahydro- 11H- indeno[1,2- b]quinolin- 11- one
Smiles: Clc1cccc(c1)C1C2=C(O)CC(CC2=NC2=C1C(=O)c1c2cccc1)(C)C

STK589021
Synonyms: 2- {[5- (3- chlorophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,6- dimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cccc1C)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK589024
Synonyms: 3- (9- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)phenol
Smiles: CC1CCc2c(C1)sc1c2c2nc(nn2cn1)c1cccc(c1)O

STK589027
Synonyms: N- (4- fluorophenyl)- 2- (3- oxo- 2,3- dihydro- 1H- isoindol- 1- yl)acetamide
Smiles: O=C(CC1NC(=O)c2c1cccc2)Nc1ccc(cc1)F

STK589028
Synonyms: N- cyclooctyl- 2- (5- hydroxy- 4,7- dimethyl- 2- oxo- 2H- chromen- 3- yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c(O)cc(c2)C)NC1CCCCCCC1

STK589032
Synonyms: (4E)- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 5- (3- nitrophenyl)- 1- (1,3- thiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1nccs1)/O

STK589034
Synonyms: 9a- [(E)- 2- {4- [(3- chlorobenzyl)oxy]- 3- methoxyphenyl}ethenyl]- 7,9,9- trimethyl- 9,9a- dihydro- 1H- imidazo[1,2- a]indol- 2(3H)- one
Smiles: COc1cc(ccc1OCc1cccc(c1)Cl)/C=C/C12NC(=O)CN1c1c(C2(C)C)cc(cc1)C

STK589035
Synonyms: 1- {[1- (tert- butoxycarbonyl)- 4- phenylpiperidin- 4- yl]carbonyl}- L- proline
Smiles: OC(=O)[C@@H]1CCCN1C(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1

STK589037
Synonyms: N'- [(E)- (3,4- dihydroxyphenyl)methylidene]- 3,3- dimethyl- 2- methylidenebicyclo[2.2.1]heptane- 1- carbohydrazide
Smiles: O=C(C12CCC(C1)C(C2=C)(C)C)N/N=C/c1ccc(c(c1)O)O

STK589039
Synonyms: 2- [(2E)- {[5- (2- fluorophenyl)furan- 2- yl]methylidene}hydrazinylidene]- 2,3- dihydro- 1H- benzimidazole
Smiles: Fc1ccccc1c1ccc(o1)/C=N/N=c/1\[nH]c2c([nH]1)cccc2

STK589040
Synonyms: (3,4- dimethylphenyl)(3,5,6,7- tetrahydro- 1'H- spiro[imidazo[4,5- c]pyridine- 4,4'- piperidin]- 1'- yl)methanone
Smiles: O=C(c1ccc(c(c1)C)C)N1CCC2(CC1)NCCc1c2[nH]cn1

STK589041
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4,6- trimethylphenyl)acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2C)C)nnc1c1cccc(c1)Cl

STK589044
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- chlorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- ethoxyphenyl)acetamide
Smiles: CCOc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK589045
Synonyms: 1'- ethyl- 2'- methyl- 6'- nitro- 1,3- diphenyl- 1',4'- dihydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinoline]- 2,4,6(1H,3H)- trione
Smiles: CCN1c2ccc(cc2CC2(C1C)C(=O)N(c1ccccc1)C(=O)N(C2=O)c1ccccc1)[N+](=O)[O-]

STK589046
Synonyms: N- (3- chlorophenyl)- 2- {[5- (2- fluorophenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)Cl)nnc1c1ccccc1F

STK589048
Synonyms: 2- (2,5- dimethoxyphenyl)- 5,6,7,8- tetrahydroquinoxaline1,4- dioxide
Smiles: COc1ccc(cc1c1c[n+]([O-])c2c([n+]1[O-])CCCC2)OC

STK589049
Synonyms: 7- (3- chlorobenzyl)- 8- {[4- (3- chlorophenyl)piperazin- 1- yl]methyl}- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Clc1cccc(c1)Cn1c(CN2CCN(CC2)c2cccc(c2)Cl)nc2c1c(O)nc(=O)n2C

STK589050
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,4- dichlorophenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)Cl)Cl)nnc1c1cccc(c1)Cl

STK589051
Synonyms: 5- (2- chlorophenyl)- 4- ({(E)- [4- (propan- 2- yl)phenyl]methylidene}amino)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(C)C

STK589052
Synonyms: 4- (3- bromophenyl)- 1- (4- methylphenyl)- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: Cc1ccc(cc1)N1C(=O)CC(C2=C1COC2=O)c1cccc(c1)Br

STK589054
Synonyms: 2- (3,4- dimethoxyphenyl)- N- [(2Z)- 5,5- dioxido- 3- (prop- 2- en- 1- yl)tetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]acetamide
Smiles: C=CCN1/C(=N/C(=O)Cc2ccc(c(c2)OC)OC)/SC2C1CS(=O)(=O)C2

STK589055
Synonyms: 8- (4- chlorophenyl)- 11- (2- methoxyphenyl)- 10- methyl- 2- (pyridin- 3- yl)- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1cccnc1)c1ccc(cc1)Cl

STK589056
Synonyms: (5Z)- 5- {[2,5- dimethyl- 1- (4- methylphenyl)- 1H- pyrrol- 3- yl]methylidene}- 6- hydroxy- 3- phenylpyrimidine- 2,4(3H,5H)- dione
Smiles: Cc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=NC(=O)N(C1=O)c1ccccc1)O

STK589059
Synonyms: N- (2,4- dimethoxyphenyl)- 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: COc1ccc(c(c1)OC)NC(=O)Cn1c2c(c3c1ccc(c3)OC)nc1n(c2=O)CCCS1

STK589060
Synonyms: N- (2,4- dichlorophenyl)- 3- (4- oxoquinazolin- 3(4H)- yl)propanamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CCn1cnc2c(c1=O)cccc2

STK589061
Synonyms: 3- [(4- methylphenoxy)methyl]- 4- (4- methylphenyl)- 5- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 4H- 1,2,4- triazole
Smiles: Cc1ccc(cc1)n1c(SC/C=C/c2ccccc2)nnc1COc1ccc(cc1)C

STK589062
Synonyms: 2- (ethylsulfanyl)- 6,6- dimethyl- 9- (2,3,4- trimethoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CCSc1nc2n(n1)C(C1=C(O)CC(CC1=N2)(C)C)c1ccc(c(c1OC)OC)OC

STK589066
Synonyms: (2E)- 3- [2- (azepan- 1- yl)- 9- methyl- 4- oxo- 4H- pyrido[1,2- a]pyrimidin- 3- yl]- 2- [(4- chlorophenyl)sulfonyl]prop- 2- enenitrile
Smiles: N#C/C(=C\c1c(nc2n(c1=O)cccc2C)N1CCCCCC1)/S(=O)(=O)c1ccc(cc1)Cl

STK589068
Synonyms: 8- (4- chlorophenyl)- 4- hydroxy- 1,7- dimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Clc1ccc(cc1)n1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK589072
Synonyms: 1,3- dimethyl- 8- [(3- methylpiperidin- 1- yl)methyl]- 7- (3- phenylpropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC1CCCN(C1)Cc1nc2c(n1CCCc1ccccc1)c(=O)n(c(=O)n2C)C

STK589073
Synonyms: 9- (3- chlorophenyl)- 3- (2- fluorobenzyl)- 1- methyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: Clc1cccc(c1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1F

STK589074
Synonyms: 2- (4- methoxybenzyl)- 14- phenyl- 14H- benzo[7,8]chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccc(cc1)Cc1nc2n(n1)cnc1c2C(c2ccccc2)c2c(O1)c1ccccc1cc2

STK589077
Synonyms: methylN- [(2- fluorobenzyl)carbamoyl]- D- leucinate
Smiles: COC(=O)[C@H](NC(=O)NCc1ccccc1F)CC(C)C

STK589079
Synonyms: 3- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]- N- (1,2,3,4- tetrahydronaphthalen- 1- yl)propanamide
Smiles: O=C(NC1CCCc2c1cccc2)CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK589080
Synonyms: 2- (4- tert- butyl- 2,6- dimethylbenzyl)- 6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1cc2CCN(Cc2cc1OC)Cc1c(C)cc(cc1C)C(C)(C)C

STK589081
Synonyms: methylN- [(4- methylpiperazin- 1- yl)carbonyl]- D- valinate
Smiles: COC(=O)[C@@H](C(C)C)NC(=O)N1CCN(CC1)C

STK589082
Synonyms: 4- chloro- N- [6- chloro- 3- (4- methoxyphenyl)- 4- oxo- 4H- chromen- 2- yl]benzamide
Smiles: COc1ccc(cc1)c1c(NC(=O)c2ccc(cc2)Cl)oc2c(c1=O)cc(cc2)Cl

STK589083
Synonyms: 3- [(3a'S,6a'R)- 5'- (4- acetylphenyl)- 6- chloro- 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(cc1)C(=O)C)C(=O)Nc1c2ccc(c1C)Cl

STK589085
Synonyms: N'- {(1E)- 1- [2- hydroxy- 1- (4- methoxyphenyl)- 4,6- dioxo- 1,6- dihydropyrimidin- 5(4H)- ylidene]ethyl}benzohydrazide
Smiles: COc1ccc(cc1)N1C(=NC(=O)/C(=C(\NNC(=O)c2ccccc2)/C)/C1=O)O

STK589087
Synonyms: N- (2,3- dimethoxybenzyl)- 2- (1,1- dioxido- 3- oxo- 1,2- benzothiazol- 2(3H)- yl)- N- (prop- 2- en- 1- yl)acetamide
Smiles: C=CCN(C(=O)CN1C(=O)c2c(S1(=O)=O)cccc2)Cc1cccc(c1OC)OC

STK589088
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- 1- (4- methylphenyl)ethanone
Smiles: Cc1ccc(cc1)C(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK589089
Synonyms: 2- [(4- chlorophenoxy)methyl]- 10- 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: Clc1ccc(cc1)OCc1nn2c(n1)c1c(nc2)Oc2c(C1c1cccnc1)c(C)nn2c1ccccc1

STK589093
Synonyms: 4- {(2E)- 2- [4- methoxy- 3- (morpholin- 4- ylmethyl)benzylidene]hydrazinyl}- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine
Smiles: COc1ccc(cc1CN1CCOCC1)/C=N/Nc1ncnc2c1c1CCCCc1s2

STK589095
Synonyms: 2- (6- ethoxy- 1,3- benzothiazol- 2- yl)- 1- (3,4,5- trimethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cc(OC)c(c(c1)OC)OC)c(=O)c1c(o2)cccc1

STK589096
Synonyms: 8- (2- chlorobenzyl)- 4- hydroxy- 1,7- dimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Clc1ccccc1Cn1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK589097
Synonyms: 7- chloro- 1',3,3'- trimethyl- 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: CN1CCN2C(C1)C1(Cc3c2cccc3Cl)C(=O)N(C)C(=O)N(C1=O)C

STK589098
Synonyms: 2- {[5- (3- chlorophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (3,4- dichlorophenyl)ethanone
Smiles: Clc1cccc(c1)c1nnc(n1c1ccccc1)SCC(=O)c1ccc(c(c1)Cl)Cl

STK589100
Synonyms: N- [1- (2- chlorobenzyl)- 6,6- dimethyl- 2,4- dioxo- 3- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- indol- 3- yl]acetamide
Smiles: CC(=O)NC1(C(=O)N(C2=C1C(=O)CC(C2)(C)C)Cc1ccccc1Cl)C(F)(F)F

STK589101
Synonyms: 10- methyl- 6- phenyl- 3- (pyridin- 3- ylmethyl)- 3,4- dihydro- 2H,8H- chromeno[6,7- e][1,3]oxazin- 8- one
Smiles: O=c1cc(c2ccccc2)c2c(o1)c(C)c1c(c2)CN(CO1)Cc1cccnc1

STK589103
Synonyms: 3- cyclopentyl- 2- (furan- 2- yl)- 10- methylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: Cn1c2nc(c3ccco3)n(c(=O)c2c(=O)c2c1cccc2)C1CCCC1

STK589104
Synonyms: (2Z)- 2- (4- hydroxy- 2- oxo- 1,3- thiazol- 5(2H)- ylidene)- N- (2- hydroxyphenyl)ethanamide
Smiles: O=C(Nc1ccccc1O)/C=C/1\SC(=O)N=C1O

STK589105
Synonyms: N- (furan- 2- ylmethyl)- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]pyridine- 4- carboxamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1ccncc1)Cc1ccco1

STK589106
Synonyms: N- (5- methyl- 7- phenyl- 4,5,6,7- tetrahydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)thiophene- 2- carboxamide
Smiles: CC1Nc2nc(nn2C(C1)c1ccccc1)NC(=O)c1cccs1

STK589108
Synonyms: 7- (3- chloro- 4- methylphenyl)- 2- (2- methylphenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1ccccc1c1nn2c(n1)c1cnn(c1nc2)c1ccc(c(c1)Cl)C

STK589109
Synonyms: N- (3- methoxyphenyl)- 1- (4- methoxyphenyl)- 4- (4- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1ccc(cc1)c1c(C(=O)Nc2cccc(c2)OC)n2c3c1CCCCn3c(c2)c1ccc(cc1)C

STK589112
Synonyms: ethyl4- {[(2- hydroxy- 5- oxo- 3,4,5,6,7,8- hexahydroquinolin- 4- yl)carbonyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)C1CC(=NC2=C1C(=O)CCC2)O

STK589114
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK589116
Synonyms: 1- (4- ethoxyphenyl)- N- (2- methoxyphenyl)- 4- (4- methoxyphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCOc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1OC)cc3c1ccc(cc1)OC

STK589118
Synonyms: N- (2- chlorobenzyl)- 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]hexanamide
Smiles: O=C(NCc1ccccc1Cl)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK589119
Synonyms: 2- {[4- (4- methoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (4- methylphenyl)ethanone
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)C)nnc1COc1ccccc1

STK589120
Synonyms: 5- (2- methoxyphenyl)- 4- {[(E)- (2,4,6- trimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(OC)c(c(c1)OC)/C=N/n1c(=S)[nH]nc1c1ccccc1OC

STK589121
Synonyms: (3a'S,6a'R)- 5'- (3,5- dimethylphenyl)- 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: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)c1cc(C)cc(c1)C)Cc1ccc(cc1)O)C(=O)N2

STK589122
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK589124
Synonyms: (2S)- N- (3- fluorophenyl)- 3- methyl- 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)butanamide
Smiles: Fc1cccc(c1)NC(=O)[C@@H](n1nnc2c(c1=O)cccc2)C(C)C

STK589125
Synonyms: 4- {[4- (2- fluorophenyl)piperazin- 1- ium- 1- yl]methyl}- 2- oxo- 2H- chromen- 6- olate
Smiles: [O-]c1ccc2c(c1)c(C[NH+]1CCN(CC1)c1ccccc1F)cc(=O)o2

STK589126
Synonyms: (E)- {1- [2- (diethylammonio)ethyl]- 2- (4- methoxyphenyl)- 4,5- dioxopyrrolidin- 3- ylidene}(phenyl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccccc2)/[O-])/C1c1ccc(cc1)OC)CC

STK589128
Synonyms: [10- (4- hydroxyphenyl)- 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]aceticacid
Smiles: OC(=O)CN1C(=O)C2C(C1=O)C1CC2C2C1Sc1c(C2c2ccc(cc2)O)sc(=O)[nH]1

STK589131
Synonyms: (4E)- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 5- (4- methylphenyl)- 1- (1,3- thiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C)c1nccs1)/O

STK589132
Synonyms: N- (4- ethylphenyl)- 2- {[4- (4- methylphenyl)- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1

STK589133
Synonyms: (4E)- 1- (5- bromopyridin- 2- yl)- 4- [(4- ethoxyphenyl)(hydroxy)methylidene]- 5- (3- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1ccc(cn1)Br)/O

STK589134
Synonyms: N- [(2Z)- 3- (4- butylphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]tetrahydrofuran- 2- carboxamide
Smiles: CCCCc1ccc(cc1)N1/C(=N/C(=O)C2CCCO2)/SC2C1CS(=O)(=O)C2

STK589135
Synonyms: 4- methyl- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (2- methylpropyl)benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N(Cc1cc2ccc(cc2[nH]c1=O)C)CC(C)C

STK589136
Synonyms: 7- (3- chloro- 4- fluorophenyl)- 3- (4- nitrophenyl)- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: O=C1CC2(C(=O)N1c1ccc(c(c1)Cl)F)ON=C(C2)c1ccc(cc1)[N+](=O)[O-]

STK589137
Synonyms: 3- [(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]propanamide
Smiles: COc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1cc(F)cc2

STK589139
Synonyms: 5- cyclopropyl- N'- [(1E)- 1- (3- hydroxyphenyl)ethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: Oc1cccc(c1)/C(=N/NC(=O)c1n[nH]c(c1)C1CC1)/C

STK589140
Synonyms: 4- {[(E)- (2- fluorophenyl)methylidene]amino}- 5- [3- (propan- 2- yloxy)phenyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccccc1F)C

STK589141
Synonyms: 7- benzyl- 8- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

STK589143
Synonyms: 2- {[(Z)- (2,6- dihydroxy- 4- oxopyrimidin- 5(4H)- ylidene)methyl]amino}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: N#Cc1c(N/C=C\2/C(=NC(=NC2=O)O)O)sc2c1CCCC2

STK589144
Synonyms: 2- (6- ethoxy- 1,3- benzothiazol- 2- yl)- 1- (pyridin- 4- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccncc1)c(=O)c1c(o2)cccc1

STK589147
Synonyms: 7- benzyl- 3- (3- hydroxypropyl)- 6,10- dimethyl- 3,4- dihydro- 2H,8H- chromeno[6,7- e][1,3]oxazin- 8- one
Smiles: OCCCN1COc2c(C1)cc1c(c2C)oc(=O)c(c1C)Cc1ccccc1

STK589148
Synonyms: (1Z,2E)- 1- {2- (4- hydroxy- 3- methoxyphenyl)- 1- [3- (morpholin- 4- ium- 4- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}- 3- phenylprop- 2- en- 1- olate
Smiles: COc1cc(ccc1O)C1/C(=C(\C=C\c2ccccc2)/[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1

STK589149
Synonyms: ethyl(3R)- 2'- amino- 1,5- dimethyl- 2,5'- dioxo- 1,2- dihydro- 5'H- spiro[indole- 3,4'- pyrano[3,2- c]chromene]- 3'- carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c([C@@]31c1cc(C)ccc1N(C3=O)C)c(=O)oc1c2cccc1

STK589150
Synonyms: N- (3,5- dimethylphenyl)- 2- {[4- (4- methylphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(C)cc(c1)C)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK589151
Synonyms: (3a'S,6a'R)- 5'- (4- fluorobenzyl)- 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: Fc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(O)C)C(=O)Nc2c1cccc2

STK589152
Synonyms: N- [2- (cyclohex- 1- en- 1- yl)ethyl]- 2- (5- methoxy- 4,7- dimethyl- 2- oxo- 2H- chromen- 3- yl)acetamide
Smiles: COc1cc(C)cc2c1c(C)c(c(=O)o2)CC(=O)NCCC1=CCCCC1

STK589154
Synonyms: 4- {[(1E,2Z)- 2- chloro- 3- phenylprop- 2- en- 1- ylidene]amino}- 5- (2- methylphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cl/C(=C\c1ccccc1)/C=N/n1c(=S)[nH]nc1c1ccccc1C

STK589155
Synonyms: 2- ({4- amino- 5- [5- (4- chlorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [4- (benzyloxy)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK589156
Synonyms: 4- chloro- N- [(2Z)- 5- methyl- 1,3,4- thiadiazol- 2(3H)- ylidene]benzamide
Smiles: Clc1ccc(cc1)C(=O)/N=c\1/[nH]nc(s1)C

STK589158
Synonyms: (3S,3a'R,8a'S,8b'S)- 2'- (2- bromophenyl)- 5- chloro- 7- methyl- 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: Clc1cc(C)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1Br

STK589159
Synonyms: 7'- {(E)- [1- (3,4- 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: O=C1N=C(O)/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C(=O)N1c1ccc(c(c1)C)C

STK589161
Synonyms: 1- {N- [3- (3,5,9- trimethyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)propanoyl]glycyl}piperidine- 4- carboxylicacid
Smiles: O=C(CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C)NCC(=O)N1CCC(CC1)C(=O)O

STK589162
Synonyms: 3- (furan- 2- ylmethyl)- 2- [(1- hydroxybutan- 2- yl)amino]- 3,5,6,7,8,9- hexahydro- 4H- cyclohepta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: CCC(Nc1nc2sc3c(c2c(=O)n1Cc1ccco1)CCCCC3)CO

STK589163
Synonyms: 4- {[(3,5- dimethylphenyl)ammonio]methyl}- 2- oxo- 7- phenyl- 2H- chromen- 6- olate
Smiles: Cc1cc(C)cc(c1)[NH2+]Cc1cc(=O)oc2c1cc([O-])c(c2)c1ccccc1

STK589164
Synonyms: 6- butyl- 2- [(4- chlorobenzyl)sulfanyl]- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCCCc1c(C)nc2n(c1O)nc(n2)SCc1ccc(cc1)Cl

STK589165
Synonyms: N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (2- methylpropyl)tetrahydrofuran- 2- carboxamide
Smiles: CC(CN(C(=O)C1CCCO1)Cc1cc2ccc(cc2[nH]c1=O)C)C

STK589166
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 2- {[4- (4- methylphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1

STK589167
Synonyms: (5E)- 1- (2- chlorophenyl)- 5- ({[3- (dimethylamino)propyl]amino}methylidene)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CN(CCCN/C=C/1\C(=O)N=C(N(C1=O)c1ccccc1Cl)S)C

STK589168
Synonyms: 3- [(4- chlorophenoxy)methyl]- 5- [(3- methoxybenzyl)sulfanyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazole
Smiles: C=CCn1c(COc2ccc(cc2)Cl)nnc1SCc1cccc(c1)OC

STK589169
Synonyms: 9- (3- bromo- 4- hydroxy- 5- methoxyphenyl)- 6,6- dimethyl- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1cc(cc(c1O)Br)C1C2=C(O)CC(CC2=Nc2n1ncn2)(C)C

STK589170
Synonyms: N- (4- chlorophenyl)- 2- ({4- (4- ethoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Cl)nnc1COc1ccc(cc1)C

STK589172
Synonyms: 2- chloro- N- [4- (4- chlorophenyl)- 6- methyl- 2- (4- methylphenyl)- 5- oxo- 2,5- dihydropyridazin- 3- yl]benzamide
Smiles: Cc1ccc(cc1)n1nc(C)c(=O)c(c1NC(=O)c1ccccc1Cl)c1ccc(cc1)Cl

STK589173
Synonyms: 7- chloro- 3- methyl- 1',3'- bis(2- methylpropyl)- 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: CC(CN1C(=O)N(CC(C)C)C(=O)C2(C1=O)Cc1c(Cl)cccc1N1C2CN(C)CC1)C

STK589174
Synonyms: tert- butyl[(1S)- 2- methyl- 1- {5- [(3- methylbenzyl)sulfonyl]- 1,3,4- oxadiazol- 2- yl}propyl]carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc(o1)S(=O)(=O)Cc1cccc(c1)C)C(C)C

STK589175
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- (3,4- dimethoxyphenyl)- 1- (5- methyl- 1,3,4- thiadiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1OC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)C

STK589176
Synonyms: N- methyl- N- [1- (4- nitrophenyl)[1,2,4]triazolo[4,3- a]quinoxalin- 4- yl]benzenesulfonamide
Smiles: [O-][N+](=O)c1ccc(cc1)c1nnc2n1c1ccccc1nc2N(S(=O)(=O)c1ccccc1)C

STK589177
Synonyms: N- (2- chloro- 4,6- dimethylphenyl)- 2- ({4- ethyl- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2c(C)cc(cc2Cl)C)nnc1COc1ccc(cc1)C

STK589178
Synonyms: 1- {[4- (4- chlorophenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 3,3- dimethylbutan- 2- one
Smiles: Clc1ccc(cc1)n1c(SCC(=O)C(C)(C)C)nnc1c1cccc(c1)C

STK589180
Synonyms: 4- (3- bromo- 4- ethoxyphenyl)- 3,4,5,6- tetrahydrobenzo[h]quinazoline- 2- thiol
Smiles: CCOc1ccc(cc1Br)C1NC(=NC2=C1CCc1c2cccc1)S

STK589181
Synonyms: 4- ({4- chloro- N- [(3,5,9- trimethyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)acetyl]phenylalanyl}amino)butanoicacid
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C)NC(C(=O)NCCCC(=O)O)Cc1ccc(cc1)Cl

STK589182
Synonyms: 2- (2- chlorophenyl)- 3- (3- methoxypropyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COCCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)c1ccccc1Cl

STK589185
Synonyms: 9- methoxy- 6- [2- (3- methylbutoxy)benzyl]- 6H- indolo[2,3- b]quinoxaline
Smiles: COc1ccc2c(c1)c1nc3ccccc3nc1n2Cc1ccccc1OCCC(C)C

STK589186
Synonyms: tert- butyl(3S)- 3- {[(2S)- 2- (cyclopentylcarbamoyl)pyrrolidin- 1- yl]carbonyl}- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: O=C([C@@H]1CCCN1C(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)NC1CCCC1

STK589187
Synonyms: 2- (4,6- dimethyl- 1,3- benzothiazol- 2- yl)- 1- phenyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1cc(C)c2c(c1)sc(n2)N1C(=O)c2c(C1c1ccccc1)c(=O)c1c(o2)cccc1

STK589188
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [2- chloro- 5- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cc(ccc1Cl)C(F)(F)F)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK589189
Synonyms: (5Z)- 2,6- dihydroxy- 5- {1- [(2- hydroxyethyl)amino]propylidene}pyrimidin- 4(5H)- one
Smiles: OCCN/C(=C\1/C(=NC(=NC1=O)O)O)/CC

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