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

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STK581824
Synonyms: N- [2- (dimethylamino)ethyl]- 1- ethyl- 5- methoxy- 2- methyl- 1H- indole- 3- carboxamide
Smiles: COc1ccc2c(c1)c(C(=O)NCCN(C)C)c(n2CC)C

STK581826
Synonyms: (2'S,3R,7a'S)- 5- bromo- N- (4- methoxyphenyl)- 2- oxo- 1,1',2,2',5',6',7',7a'- octahydrospiro[indole- 3,3'- pyrrolizine]- 2'- carboxamide
Smiles: COc1ccc(cc1)NC(=O)[C@H]1C[C@H]2N([C@@]31C(=O)Nc1c3cc(Br)cc1)CCC2

STK581827
Synonyms: 2'- hydroxy- 1'- (2- phenylethyl)- 15,16- dihydro- 4'H,4bH,6H,7H- spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1- a]isoquinoline- 5,5'- pyrimidine]- 4',6',7(1'H)- trione
Smiles: OC1=NC(=O)C2(C(=O)N1CCc1ccccc1)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2

STK581828
Synonyms: (2E)- 3- (2,4- dichlorophenyl)- 1- (7- methylidene- 3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)prop- 2- en- 1- one
Smiles: Clc1ccc(c(c1)Cl)/C=C/C(=O)N1CCc2c(C1=C)cc1c(c2)OCCCO1

STK581831
Synonyms: (3Z)- 4- imino- 3- {[1- (2- methoxyethyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]methylidene}- 3,4- dihydro- 2H- pyrimido[2,1- b][1,3]benzothiazol- 2- one
Smiles: COCCn1c(C)cc(c1C)/C=C/1\C(=O)N=c2n(C1=N)c1ccccc1s2

STK581833
Synonyms: ethyl(8- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydro- 7H- purin- 7- yl)acetate
Smiles: CCOC(=O)Cn1c(CN2CCN(CC2)c2ccc(cc2)F)nc2c1c(=O)n(c(=O)n2C)C

STK581834
Synonyms: 4- [(3a'S,6a'R)- 5- chloro- 3'- (3,4- dihydroxybenzyl)- 2,4',6'- trioxo- 1,2,2',3',3a',4',6',6a'- octahydro- 5'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 5'- yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(c(c2)O)O)C(=O)Nc2c1cc(Cl)cc2

STK581835
Synonyms: 2- methyl- 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(c1c1n2nc(n1)C)CCCC3

STK581837
Synonyms: 9- (4- methoxyphenyl)- 6- phenyl- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1

STK581838
Synonyms: (4E)- 1- [5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]- 5- (3- chlorophenyl)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]pyrrolidine- 2,3- dione
Smiles: Clc1cccc(c1)C1N(c2nnc(s2)SCc2ccccc2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK581839
Synonyms: N- cyclopentyl- N- (thiophen- 2- ylmethyl)morpholine- 4- carboxamide
Smiles: O=C(N(C1CCCC1)Cc1cccs1)N1CCOCC1

STK581841
Synonyms: 1- (furan- 2- ylmethyl)- 6- propyl- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: CCCN1CNc2c(C1)c(=O)nc(n2Cc1ccco1)S

STK581842
Synonyms: 1- (4- acetyl- 5- methyl- 1,3- thiazol- 2- yl)- 3- benzylpyrrolidine- 2,5- dione
Smiles: O=C1CC(C(=O)N1c1sc(c(n1)C(=O)C)C)Cc1ccccc1

STK581843
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- [3- ethoxy- 4- (3- methylbutoxy)phenyl]- 1- {5- [(4- methylbenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}pyrrolidine- 2,3- dione
Smiles: CCOc1cc(ccc1OCCC(C)C)C1N(c2nnc(s2)SCc2ccc(cc2)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK581845
Synonyms: methyl[(7- chloro- 1- hydroxy- 9- oxo- 9H- xanthen- 3- yl)oxy]acetate
Smiles: COC(=O)COc1cc(O)c2c(c1)oc1c(c2=O)cc(cc1)Cl

STK581846
Synonyms: 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- ol
Smiles: CC(c1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3O)C

STK581847
Synonyms: (4E)- 5- (3,4- dichlorophenyl)- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 1- (1,3- thiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)Cl)Cl)c1nccs1)/O

STK581849
Synonyms: (5Z)- 5- [5- (1,3- benzodioxol- 5- yl)pyrazolidin- 3- ylidene]- 1- benzylpyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/1\NNC(C1)c1ccc2c(c1)OCO2)Cc1ccccc1

STK581850
Synonyms: 9- (2- hydroxyphenyl)- 6- (3,4,5- trimethoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1c(OC)cc(cc1OC)C1CC(=C2C(=Nc3n(C2c2ccccc2O)ncn3)C1)O

STK581851
Synonyms: 3- [(3a'S,6a'R)- 5- chloro- 5'- (2- chlorobenzyl)- 2,4',6'- trioxo- 1,2,3',3a',4',5',6',6a'- octahydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 3'- yl]propanoicacid
Smiles: OC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cc(Cl)cc1

STK581852
Synonyms: 1- (4- chlorophenyl)- N- (2- methoxyphenyl)- 4- phenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1ccccc1NC(=O)c1c(c2ccc(cc2)Cl)c2c3n1cc(n3CCCC2)c1ccccc1

STK581854
Synonyms: 2- amino- N- (2- methoxyethyl)- 1- [4- (morpholin- 4- yl)phenyl]- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)N1CCOCC1

STK581856
Synonyms: (4E)- 4- [hydroxy(thiophen- 2- yl)methylidene]- 5- (4- methoxyphenyl)- 1- [5- (methylsulfanyl)- 1,3,4- thiadiazol- 2- yl]pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)C1/C(=C(/c2cccs2)\O)/C(=O)C(=O)N1c1nnc(s1)SC

STK581857
Synonyms: 3- (3,4,5- trimethoxyphenyl)- 3,4,7,8,9,10- hexahydro- 2H,6H- benzo[3,4]chromeno[8,7- e][1,3]oxazin- 6- one
Smiles: COc1cc(cc(c1OC)OC)N1COc2c(C1)c1oc(=O)c3c(c1cc2)CCCC3

STK581858
Synonyms: 3- (2- hydroxyphenyl)- 1- (1H- indol- 3- ylmethyl)- 5- (4- methylphenyl)- 4,6- dioxooctahydropyrrolo[3,4- c]pyrrole- 1- carboxylicacid
Smiles: Cc1ccc(cc1)N1C(=O)C2C(C1=O)C(NC2c1ccccc1O)(Cc1c[nH]c2c1cccc2)C(=O)O

STK581859
Synonyms: 2- (6- methyl- 1,3- benzothiazol- 2- yl)- 1- (3- nitrophenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)cccc1

STK581861
Synonyms: (3S,3a'S,8a'S,8b'R)- 2'- (prop- 2- en- 1- yl)- 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: C=CCN1C(=O)[C@@H]2[C@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cccc2

STK581862
Synonyms: 5- [3- (benzyloxy)phenyl]- N'- [(E)- (3- hydroxyphenyl)methylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: Oc1cccc(c1)/C=N/NC(=O)c1n[nH]c(c1)c1cccc(c1)OCc1ccccc1

STK581864
Synonyms: N- [4- (dimethylamino)phenyl]- 2- {[5- (3- methoxyphenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)N(C)C)nnc1c1cccc(c1)OC

STK581865
Synonyms: N- (2- ethoxyphenyl)- 2- {[4- (4- methylphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK581866
Synonyms: (5E)- 5- {[1- (2- chlorobenzyl)- 1H- indol- 3- yl]methylidene}- 1- ethyl- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CCN1C(=NC(=O)/C(=C\c2cn(c3c2cccc3)Cc2ccccc2Cl)/C1=O)S

STK581870
Synonyms: 5- [(3- bromobenzyl)amino]- 2- (morpholin- 4- ium- 4- yl)benzoate
Smiles: Brc1cccc(c1)CNc1ccc(c(c1)C(=O)[O-])[NH+]1CCOCC1

STK581871
Synonyms: 3- (3- chlorophenyl)- 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)n1c1cccc(c1)Cl)CCCCC3

STK581872
Synonyms: 4- (furan- 2- ylmethyl)- 3- [(3- methoxybenzyl)sulfanyl]- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazole
Smiles: COc1cccc(c1)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK581873
Synonyms: 5- (4- fluorophenyl)- 4- {[(E)- (2- methylphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccccc1C

STK581875
Synonyms: 3- [4- (4- chlorophenoxy)butyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1ccc(cc1)Cl

STK581876
Synonyms: 2- {4- [4- (benzyloxy)phenoxy]quinazolin- 2- yl}- 6- methoxyphenol
Smiles: COc1cccc(c1O)c1nc(Oc2ccc(cc2)OCc2ccccc2)c2c(n1)cccc2

STK581877
Synonyms: 7- (2,5- dimethylbenzyl)- 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(n1Cc1cc(C)ccc1C)c(=O)n(c(=O)n2C)C

STK581878
Synonyms: 4- {[(E)- (4- hydroxyphenyl)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)O

STK581879
Synonyms: (3S,3a'R,8a'S,8b'S)- 2'- (2- bromo- 4- methylphenyl)- 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: Cc1ccc(c(c1)Br)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(Cl)cc2C

STK581881
Synonyms: 5- (2- methylpropyl)- N- [2- (morpholin- 4- yl)ethyl]- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinolin- 8- amine
Smiles: CC(Cc1nc2oc3c(c2c2c1CCCC2)ncnc3NCCN1CCOCC1)C

STK581882
Synonyms: 1'- butyl- 2'- hydroxy- 3- nitro- 6a,7,8,9,10,11- hexahydro- 4'H,5H- spiro[azepino[1,2- a]quinoline- 6,5'- pyrimidine]- 4',6'(1'H)- dione
Smiles: CCCCN1C(=NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCCCC1)[N+](=O)[O-])O

STK581883
Synonyms: 9- hydroxy- 7,7- dimethyl- 10- (3- methylphenyl)- 6,7,8,10- tetrahydro- 11H- indeno[1,2- b]quinolin- 11- one
Smiles: Cc1cccc(c1)C1C2=C(O)CC(CC2=NC2=C1C(=O)c1c2cccc1)(C)C

STK581885
Synonyms: (4E)- 2- (2,4- dimethoxyphenyl)- 4- {[(2,5- dimethoxyphenyl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc(c(c1)OC)N1C(=O)/C(=C/Nc2cc(OC)ccc2OC)/c2c(C1=O)cccc2

STK581886
Synonyms: (3a'S,6a'R)- 5'- (2- chlorobenzyl)- 3'- (3,4- dihydroxybenzyl)- 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(Cc2ccccc2Cl)C(=O)[C@@H]2[C@H]1C(Cc1ccc(c(c1)O)O)NC12C(=O)Nc2c1cccc2

STK581889
Synonyms: 5- (3- ethoxyphenyl)- 4- {[(E)- (3- fluorophenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cccc(c1)F

STK581892
Synonyms: 4- {[(E)- biphenyl- 4- ylmethylidene]amino}- 5- (pyridin- 3- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1/N=C/c1ccc(cc1)c1ccccc1)c1cccnc1

STK581893
Synonyms: ethylN- ({[4- (furan- 2- ylmethyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)glycinate
Smiles: CCOC(=O)CNC(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)OC

STK581894
Synonyms: 8- (morpholin- 4- yl)- 5- propyl- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinoline
Smiles: CCCc1nc2oc3c(c2c2c1CCCC2)ncnc3N1CCOCC1

STK581895
Synonyms: (5E)- 5- [(azepan- 1- ylamino)methylidene]- 3- (4- fluorobenzyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: Fc1ccc(cc1)CN1C(=O)N=C(/C(=C\NN2CCCCCC2)/C1=O)O

STK581896
Synonyms: 4- ({(E)- [3- (benzyloxy)- 4- methoxyphenyl]methylidene}amino)- 5- (3- chlorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1OCc1ccccc1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)Cl

STK581899
Synonyms: 4- [(2E)- 2- {[1- (2,4- dichlorobenzyl)- 1H- indol- 3- yl]methylidene}hydrazinyl]benzoicacid
Smiles: Clc1ccc(c(c1)Cl)Cn1cc(c2c1cccc2)/C=N/Nc1ccc(cc1)C(=O)O

STK581901
Synonyms: N- [5- hydroxy- 2- (2- methylphenyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)Nc1cc(O)nc2n1nc(n2)c1ccccc1C

STK581902
Synonyms: 4- methyl- 3- (3- methylphenyl)- 5- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 4H- 1,2,4- triazole
Smiles: Cc1cccc(c1)c1nnc(n1C)SC/C=C/c1ccccc1

STK581903
Synonyms: 1- amino- 4- [(3- methoxyphenyl)amino]- 2- (morpholin- 4- yl)anthracene- 9,10- dione
Smiles: COc1cccc(c1)Nc1cc(N2CCOCC2)c(c2c1C(=O)c1ccccc1C2=O)N

STK581905
Synonyms: 1- (4- methoxyphenyl)- 2- {[4- (4- methylphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}ethanone
Smiles: COc1ccc(cc1)C(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK581906
Synonyms: N- [(2Z)- 3- (2,5- dimethylphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]butanamide
Smiles: CCCC(=O)/N=C/1\SC2C(N1c1cc(C)ccc1C)CS(=O)(=O)C2

STK581907
Synonyms: 5- (2- chlorophenyl)- 4- {[(E)- (3,4- dimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(ccc1OC)/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

STK581910
Synonyms: 2- [4- (diphenylmethyl)piperazin- 1- yl]- 6- phenylpyrimidin- 4- ol
Smiles: Oc1nc(nc(c1)c1ccccc1)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK581912
Synonyms: N- (2- chloro- 4,6- dimethylphenyl)- 2- {[4- (4- methoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2Cl)C)nnc1c1cccc(c1)C

STK581913
Synonyms: (3a'S,6a'R)- 3'- benzyl- 5'- butyl- 5- chloro- 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(NC2Cc2ccccc2)C(=O)Nc2c1cc(Cl)cc2

STK581914
Synonyms: 1- (3- methoxyphenyl)- 3- (1- methyl- 1H- benzimidazol- 2- yl)- 1H- pyrrolo[2,3- b]quinoxalin- 2- amine
Smiles: COc1cccc(c1)n1c(N)c(c2c1nc1ccccc1n2)c1nc2c(n1C)cccc2

STK581915
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 1- (6- methoxy- 1,3- benzothiazol- 2- yl)- 5- (4- methoxyphenyl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC

STK581916
Synonyms: 6- [(3E)- 3- [hydroxy(4- nitrophenyl)methylidene]- 2- (4- methoxyphenyl)- 4,5- dioxopyrrolidin- 1- yl]hexanoicacid
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=O)C(=O)N1CCCCCC(=O)O

STK581918
Synonyms: (6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)[4- (trifluoromethyl)phenyl]methanone
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=O)c1ccc(cc1)C(F)(F)F

STK581919
Synonyms: 4- [(2E)- 2- {[5- (4- sulfamoylphenyl)furan- 2- yl]methylidene}hydrazinyl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)N/N=C/c1ccc(o1)c1ccc(cc1)S(=O)(=O)N

STK581920
Synonyms: 5- bromo- N- [2- (1H- imidazol- 5- yl)ethyl]furan- 2- carboxamide
Smiles: Brc1ccc(o1)C(=O)NCCc1cnc[nH]1

STK581921
Synonyms: (1S,2S)- N'- {(E)- [5- (3- nitrophenyl)furan- 2- yl]methylidene}- 2- phenylcyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1ccc(o1)c1cccc(c1)[N+](=O)[O-]

STK581923
Synonyms: (4Z)- 6- (1- benzofuran- 2- yl)- 4- [(4- chlorophenyl)imino]- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: Clc1ccc(cc1)/N=c/1\nc(N)nc([nH]1)c1cc2c(o1)cccc2

STK581925
Synonyms: 2- (dimethylamino)- 3- {(Z)- [4- oxo- 3- (3- phenylpropyl)- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: S=C1S/C(=C\c2c(nc3n(c2=O)cccc3)N(C)C)/C(=O)N1CCCc1ccccc1

STK581927
Synonyms: 6'- hydroxy- 2,4- dimethyl- 3'- phenyl- 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)c1ccccc1CC12C(=NC(=O)N(C1=O)c1ccccc1)O

STK581928
Synonyms: 1,3- dimethyl- 8- [(4- methylpiperidin- 1- yl)methyl]- 7- (2- oxopropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC1CCN(CC1)Cc1nc2c(n1CC(=O)C)c(=O)n(c(=O)n2C)C

STK581929
Synonyms: 2- methoxy- 6- [4- (2,3,5- trimethylphenoxy)quinazolin- 2- yl]phenol
Smiles: COc1cccc(c1O)c1nc(Oc2cc(C)cc(c2C)C)c2c(n1)cccc2

STK581930
Synonyms: 2- {5- [(2- methylbenzyl)sulfanyl]- 4- phenyl- 4H- 1,2,4- triazol- 3- yl}pyrazine
Smiles: Cc1ccccc1CSc1nnc(n1c1ccccc1)c1cnccn1

STK581931
Synonyms: N- [3- (1H- tetrazol- 1- yl)phenyl]- 1,3- benzodioxole- 5- carboxamide
Smiles: O=C(c1ccc2c(c1)OCO2)Nc1cccc(c1)n1cnnn1

STK581933
Synonyms: N- (3- ethoxypropyl)- 5- methyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CCOCCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCC2

STK581937
Synonyms: (2Z)- 2- (2- bromobenzylidene)- 7- {[4- (2- hydroxyethyl)piperazin- 1- ium- 1- yl]methyl}- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1ccccc1Br)/C2=O

STK581942
Synonyms: N- {[(3S)- 2- (tert- butoxycarbonyl)- 1,2,3,4- tetrahydroisoquinolin- 3- yl]carbonyl}- L- alanine
Smiles: OC(=O)[C@@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C

STK581943
Synonyms: N- {5- methyl- 1- [2- (morpholin- 4- yl)ethyl]- 2- oxo- 2,3- dihydro- 1H- indol- 3- yl}acetamide
Smiles: CC(=O)NC1C(=O)N(c2c1cc(C)cc2)CCN1CCOCC1

STK581944
Synonyms: 4- (3- bromophenyl)- 2- (4- fluorophenyl)- 1,2,3,4- tetrahydropyrimido[1,2- a]benzimidazole
Smiles: Fc1ccc(cc1)C1Nc2nc3c(n2C(C1)c1cccc(c1)Br)cccc3

STK581945
Synonyms: [4- amino- 3- (2,4- dimethylphenyl)- 2- thioxo- 2,3- dihydro- 1,3- thiazol- 5- yl](morpholin- 4- yl)methanone
Smiles: Cc1ccc(c(c1)C)n1c(=S)sc(c1N)C(=O)N1CCOCC1

STK581947
Synonyms: (3S)- N- {(2S)- 1- [(2,4- dimethylphenyl)amino]- 1- oxopropan- 2- yl}- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: Cc1ccc(c(c1)C)NC(=O)[C@@H](NC(=O)[C@H]1NCc2c(C1)cccc2)C

STK581948
Synonyms: 3- {(Z)- [3- (3- methoxypropyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (4- phenylpiperazin- 1- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: COCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2)/C1=O

STK581949
Synonyms: 8- [(4- benzylpiperidin- 1- yl)methyl]- 1,3- dimethyl- 7- (3- phenylpropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc(n2CCCc1ccccc1)CN1CCC(CC1)Cc1ccccc1

STK581951
Synonyms: 5- ethoxy- N'- [(E)- (3- hydroxy- 4- methoxyphenyl)methylidene]- 1H- indole- 2- carbohydrazide
Smiles: CCOc1ccc2c(c1)cc([nH]2)C(=O)N/N=C/c1ccc(c(c1)O)OC

STK581952
Synonyms: 4- [(2E)- 2- (2,3- dimethoxybenzylidene)hydrazinyl]- 8- methyl- 5H- pyrimido[5,4- b]indole
Smiles: COc1c(/C=N/Nc2ncnc3c2[nH]c2c3cc(cc2)C)cccc1OC

STK581953
Synonyms: 4- {[(E)- (2- ethoxyphenyl)methylidene]amino}- 5- (3,4,5- trimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccccc1/C=N/n1c(=S)[nH]nc1c1cc(OC)c(c(c1)OC)OC

STK581955
Synonyms: methylN- [(4- sulfamoylphenyl)carbamoyl]- L- leucinate
Smiles: COC(=O)[C@@H](NC(=O)Nc1ccc(cc1)S(=O)(=O)N)CC(C)C

STK581957
Synonyms: 3- (2- methoxyphenoxy)- 8- [(4- methylpiperidinium- 1- yl)methyl]- 4- oxo- 4H- chromen- 7- olate
Smiles: COc1ccccc1Oc1coc2c(c1=O)ccc(c2C[NH+]1CCC(CC1)C)[O-]

STK581958
Synonyms: (3R,3'S,5'S)- N- (4- methoxyphenyl)- 5- methyl- 5'- (2- methylpropyl)- 2- oxo- 1,2- dihydrospiro[indole- 3,2'- pyrrolidine]- 3'- carboxamide
Smiles: COc1ccc(cc1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(C)cc1)CC(C)C

STK581959
Synonyms: N- [1- (4- fluorophenyl)- 2- hydroxy- 4,6- dioxo- 5- (trifluoromethyl)- 4,5,6,7- tetrahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]- 2- (2- oxopyrrolidin- 1- yl)acetamide
Smiles: O=C(NC1(C(=O)Nc2c1c(=O)nc(n2c1ccc(cc1)F)O)C(F)(F)F)CN1CCCC1=O

STK581961
Synonyms: ([(2- methylbenzyl)sulfanyl]{[3- (trifluoromethyl)phenyl]amino}methylidene)propanedinitrile
Smiles: N#CC(=C(Nc1cccc(c1)C(F)(F)F)SCc1ccccc1C)C#N

STK581962
Synonyms: 2- ({4- (4- chlorophenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,4- dimethoxyphenyl)acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccc(cc1)C

STK581963
Synonyms: (5E)- 5- {4- [(4- fluorobenzyl)oxy]benzylidene}- 4- hydroxy- 1,3- thiazol- 2(5H)- one
Smiles: OC1=NC(=O)S/C/1=C/c1ccc(cc1)OCc1ccc(cc1)F

STK581964
Synonyms: 6- chloro- 1- hydroxy- 9- oxo- 9H- xanthen- 3- ylN- [(benzyloxy)carbonyl]- beta- alaninate
Smiles: O=C(Oc1cc(O)c2c(c1)oc1c(c2=O)ccc(c1)Cl)CCNC(=O)OCc1ccccc1

STK581965
Synonyms: 2,2- dimethyl- N- [3- (morpholin- 4- yl)propyl]- 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: CC(c1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCCCN1CCOCC1)C

STK581966
Synonyms: N- (2- chlorophenyl)- 1- (4- fluorophenyl)- 4- (4- methoxyphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1ccccc1Cl)c1ccc(cc1)F

STK581967
Synonyms: N- (5- chloro- 2,4- dimethoxyphenyl)- 3- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanamide
Smiles: COc1cc(OC)c(cc1NC(=O)CCn1nnc2c(c1=O)cccc2)Cl

STK581968
Synonyms: 8- benzyl- 1,7- dimethyl- 3- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: Cn1c(=O)n(CCN2CCCCC2)c(=O)c2c1nc1n2cc(n1Cc1ccccc1)C

STK581970
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(3,4- dimethoxyphenyl)carbonyl]- 2'- [(4- propoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: CCCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(c(c2)OC)OC)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK581972
Synonyms: 3- (3,4- difluorophenyl)- 3,4,7,8,9,10- hexahydro- 2H,6H- benzo[3,4]chromeno[8,7- e][1,3]oxazin- 6- one
Smiles: Fc1ccc(cc1F)N1COc2c(C1)c1oc(=O)c3c(c1cc2)CCCC3

STK581973
Synonyms: (2Z)- 1- (biphenyl- 4- yl)- 2- (7,8- dihydro[1,3]dioxolo[4,5- g]isoquinolin- 5(6H)- ylidene)ethanone
Smiles: O=C(c1ccc(cc1)c1ccccc1)/C=C/1\NCCc2c1cc1OCOc1c2

STK581974
Synonyms: 6- {[butyl(ethyl)ammonio]methyl}- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- olate
Smiles: CCCC[NH+](Cc1c([O-])ccc2c1oc(=O)c1c2CCC1)CC

STK581976
Synonyms: 6- hydroxy- 7- [2- (4- methoxyphenyl)ethyl]- 3- methyl- 8- sulfanyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: COc1ccc(cc1)CCn1c(S)nc2c1c(O)nc(=O)n2C

STK581977
Synonyms: (3a'S,6a'R)- 5- chloro- 5'- cyclohexyl- 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: Clc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C1CCCCC1)Cc1c[nH]c3c1cccc3)C(=O)N2

STK581980
Synonyms: N- (3- fluorophenyl)- 4- [(4- oxoquinazolin- 3(4H)- yl)methyl]cyclohexanecarboxamide
Smiles: Fc1cccc(c1)NC(=O)C1CCC(CC1)Cn1cnc2c(c1=O)cccc2

STK581981
Synonyms: 3- (furan- 2- ylmethyl)- 1- [2- (pyrrolidin- 1- yl)ethyl]- 1,5,6,7,8,9- hexahydro- 2H- cyclohepta[4,5]thieno[2,3- d]pyrimidine- 2,4(3H)- dione
Smiles: O=c1c2c3CCCCCc3sc2n(c(=O)n1Cc1ccco1)CCN1CCCC1

STK581982
Synonyms: 7- (furan- 2- ylmethyl)- 5,6- dimethyl- N- [3- (morpholin- 4- yl)propyl]- 7H- pyrrolo[2,3- d]pyrimidin- 4- amine
Smiles: Cc1c(C)n(c2c1c(NCCCN1CCOCC1)ncn2)Cc1ccco1

STK581984
Synonyms: 7- [2- hydroxy- 3- (3- methylphenoxy)propyl]- 1,3- dimethyl- 8- (propylamino)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCNc1nc2c(n1CC(COc1cccc(c1)C)O)c(=O)n(c(=O)n2C)C

STK581985
Synonyms: 5- (3- ethoxyphenyl)- 4- {[(E)- (2- methoxynaphthalen- 1- yl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1c(OC)ccc2c1cccc2

STK581986
Synonyms: 4- methoxy- N- [3- (morpholin- 4- yl)propyl]- 1H- indole- 2- carboxamide
Smiles: COc1cccc2c1cc([nH]2)C(=O)NCCCN1CCOCC1

STK581987
Synonyms: N- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 2- [(2- oxo- 2H- chromen- 7- yl)oxy]acetamide
Smiles: O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)COc1ccc2c(c1)oc(=O)cc2

STK581989
Synonyms: 4,8- dimethyl- 2- oxo- 2H- chromen- 7- yl1- [(4- fluorophenyl)sulfonyl]- L- prolinate
Smiles: O=C([C@@H]1CCCN1S(=O)(=O)c1ccc(cc1)F)Oc1ccc2c(c1C)oc(=O)cc2C

STK581991
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- (2- fluorophenyl)- 1- {5- [(4- methylbenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}pyrrolidine- 2,3- dione
Smiles: Cc1ccc(cc1)CSc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccccc1F

STK581993
Synonyms: (4E)- 4- [(4- chlorophenyl)(hydroxy)methylidene]- 1- [5- (methylsulfanyl)- 1,3,4- thiadiazol- 2- yl]- 5- phenylpyrrolidine- 2,3- dione
Smiles: CSc1nnc(s1)N1C(c2ccccc2)/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=O

STK581995
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(2,4- dichlorophenyl)carbonyl]- 3'- [(3- nitrophenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Clc1ccc(c(c1)Cl)C(=O)[C@@H]1[C@@H](C(=O)c2cccc(c2)[N+](=O)[O-])N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK581997
Synonyms: (3S)- N- [(2S)- 1- (cyclohexylamino)- 4- methyl- 1- oxopentan- 2- yl]- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: CC(C[C@@H](C(=O)NC1CCCCC1)NC(=O)[C@H]1NCc2c(C1)cccc2)C

STK581998
Synonyms: 5- (4- butoxyphenyl)- N'- {(E)- [4- (propan- 2- yl)phenyl]methylidene}- 1H- pyrazole- 3- carbohydrazide
Smiles: CCCCOc1ccc(cc1)c1[nH]nc(c1)C(=O)N/N=C/c1ccc(cc1)C(C)C

STK581999
Synonyms: 4- chloro- N- [1- (3- chlorophenyl)- 2- hydroxy- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]benzamide
Smiles: Clc1ccc(cc1)C(=O)NC1(N=C(N(C1=O)c1cccc(c1)Cl)O)C(F)(F)F

STK582000
Synonyms: N- (2,5- dichlorophenyl)- 2- {[4- phenyl- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)ccc1Cl)CSc1nnc(n1c1ccccc1)c1ccccn1

STK582001
Synonyms: 9- [4- (benzyloxy)phenyl]- 6,6- dimethyl- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: OC1=C2C(=Nc3n(C2c2ccc(cc2)OCc2ccccc2)ncn3)CC(C1)(C)C

STK582002
Synonyms: N- (2,1,3- benzoxadiazol- 4- yl)- 3- [(5Z)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1cccc2c1non2)CCN1C(=S)S/C(=C\c2ccccc2)/C1=O

STK582003
Synonyms: 6'- chloro- 1,3- dipropyl- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- trione
Smiles: CCCN1C(=O)N(CCC)C(=O)C2(C1=O)Cc1c(Cl)cccc1N1C2CCC1

STK582004
Synonyms: 5- (2- methylpropyl)- 8- (pyrrolidin- 1- yl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinoline
Smiles: CC(Cc1nc2oc3c(c2c2c1CCCC2)ncnc3N1CCCC1)C

STK582005
Synonyms: 1- (4- chlorophenyl)- 1'- methyl- 6'- nitro- 2'- propyl- 1',4'- dihydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinoline]- 2,4,6(1H,3H)- trione
Smiles: CCCC1N(C)c2ccc(cc2CC21C(=O)NC(=O)N(C2=O)c1ccc(cc1)Cl)[N+](=O)[O-]

STK582006
Synonyms: N,N- dimethyl- N'- (5- propyl- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinolin- 8- yl)propane- 1,3- diamine
Smiles: CCCc1nc2oc3c(c2c2c1CCCC2)ncnc3NCCCN(C)C

STK582007
Synonyms: 2- {5- [(3- fluorobenzyl)sulfanyl]- 4- phenyl- 4H- 1,2,4- triazol- 3- yl}pyrazine
Smiles: Fc1cccc(c1)CSc1nnc(n1c1ccccc1)c1cnccn1

STK582008
Synonyms: (2Z)- 7- {[4- (2- hydroxyethyl)piperazin- 1- ium- 1- yl]methyl}- 2- [(2E)- 3- (2- methoxyphenyl)prop- 2- en- 1- ylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\C=C\c1ccccc1OC)/C2=O

STK582009
Synonyms: (2Z)- 7- {[butyl(methyl)ammonio]methyl}- 2- (3- methoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: CCCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cccc(c1)OC)/C2=O)C

STK582010
Synonyms: 3- (3- chlorophenyl)- 2- hydrazinyl- 7- methyl- 5,6,7,8- tetrahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: NNc1nc2sc3c(c2c(=O)n1c1cccc(c1)Cl)CCN(C3)C

STK582013
Synonyms: 3- cyclopentyl- N- [(2Z)- 3- (3- methoxyphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]propanamide
Smiles: COc1cccc(c1)N1/C(=N/C(=O)CCC2CCCC2)/SC2C1CS(=O)(=O)C2

STK582014
Synonyms: 7- (3- chlorobenzyl)- 1,3- dimethyl- 8- (piperidin- 1- ylmethyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Clc1cccc(c1)Cn1c(CN2CCCCC2)nc2c1c(=O)n(c(=O)n2C)C

STK582016
Synonyms: 1- (4- hydroxy- 6- methylpyrimidin- 2- yl)- 3- (2- methoxyphenyl)guanidine
Smiles: COc1ccccc1NC(=N)Nc1nc(C)cc(n1)O

STK582018
Synonyms: 5- (3- ethoxyphenyl)- 4- {[(E)- (2,4,5- trimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cc(OC)c(cc1OC)OC

STK582019
Synonyms: 2- [(E)- {[3- (ethoxycarbonyl)- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl]iminio}methyl]- 6- methoxyphenolate
Smiles: CCOC(=O)c1c(/[NH+]=C/c2cccc(c2[O-])OC)sc2c1CCC2

STK582020
Synonyms: propan- 2- yl{[4- (4- methoxyphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetate
Smiles: COc1ccc(cc1)n1c(SCC(=O)OC(C)C)nnc1c1ccccn1

STK582021
Synonyms: 3,5- dinitro- N- [(2E)- 5- propyl- 1,3,4- thiadiazol- 2(3H)- ylidene]benzamide
Smiles: CCCc1n[nH]/c(=N\C(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])/s1

STK582023
Synonyms: 1- (3- chlorophenyl)- 2- (6- methyl- 1,3- benzothiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Clc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK582025
Synonyms: (5E)- 5- [(2,5- dimethyl- 1H- pyrrol- 3- yl)methylidene]- 6- hydroxy- 2- sulfanylpyrimidin- 4(5H)- one
Smiles: SC1=NC(=O)/C(=C/c2cc([nH]c2C)C)/C(=N1)O

STK582026
Synonyms: 9- (3- ethoxy- 4- hydroxyphenyl)- 6- (4- methylphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CCOc1cc(ccc1O)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccc(cc1)C

STK582027
Synonyms: 2- {(1E)- 1- [2- (3- chlorophenyl)hydrazinylidene]ethyl}- 4- (furan- 2- yl)- 2,5,5- trimethyl- 2,5- dihydro- 1H- imidazol- 1- ol3- oxide
Smiles: Clc1cccc(c1)N/N=C(/C1(C)[N+](=C(C(N1O)(C)C)c1ccco1)[O-])\C

STK582029
Synonyms: 3- (2- methoxyphenyl)- 4- oxo- 8- (pyrrolidinium- 1- ylmethyl)- 2- (trifluoromethyl)- 4H- chromen- 7- olate
Smiles: COc1ccccc1c1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+]1CCCC1)[O-]

STK582030
Synonyms: methyl4- {[3- cyano- 4- (4- methoxyphenyl)- 6- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}- 3- oxobutanoate
Smiles: COC(=O)CC(=O)CSc1nc(cc(c1C#N)c1ccc(cc1)OC)c1cccs1

STK582031
Synonyms: 2- (5- oxo- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 6(5H)- yl)- N- phenylacetamide
Smiles: O=C(Cn1c2ccccc2c2c1c(=O)n1CCSc1n2)Nc1ccccc1

STK582032
Synonyms: ethyl4- [(6- methoxy- 1H- indol- 2- yl)carbonyl]piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cc(cc2)OC

STK582033
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- (3- ethoxyphenyl)- 1- {5- [(4- methylbenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}pyrrolidine- 2,3- dione
Smiles: CCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK582034
Synonyms: N- (3- hydroxypropyl)- 2- [(4- methyl- 6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 3- yl)oxy]acetamide
Smiles: OCCCNC(=O)COc1ccc2c(c1C)oc(=O)c1c2CCCC1

STK582035
Synonyms: 7,7- dimethyl- 2- (4- methylphenyl)- 4- [(2- phenoxyethyl)sulfanyl]- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidine
Smiles: Cc1ccc(cc1)c1nc(SCCOc2ccccc2)c2c(n1)CC(OC2)(C)C

STK582039
Synonyms: 2- (2- chlorophenyl)- 3- [2- (4- methoxyphenyl)ethyl]- 10- methylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: COc1ccc(cc1)CCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccccc1Cl

STK582040
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- (4- fluorophenyl)- 1- (6- methoxy- 1,3- benzothiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccc(cc1)F

STK582041
Synonyms: 5- ethoxy- N'- [(E)- (2,3,4- trimethoxyphenyl)methylidene]- 1H- indole- 2- carbohydrazide
Smiles: CCOc1ccc2c(c1)cc([nH]2)C(=O)N/N=C/c1ccc(c(c1OC)OC)OC

STK582042
Synonyms: 2- {[4- (4- ethoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (naphthalen- 2- yl)ethanone
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)c2ccc3c(c2)cccc3)nnc1COc1ccccc1

STK582043
Synonyms: 6- (furan- 2- ylmethyl)- 1- (4- methylphenyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: Cc1ccc(cc1)n1c(S)nc(=O)c2c1NCN(C2)Cc1ccco1

STK582044
Synonyms: (1'S,3R,3'S,7a'S)- 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)Nc1c2cccc1

STK582045
Synonyms: (8S,8aR,11aS)- 10- (4- methoxybenzyl)- 8- (phenylcarbonyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1C2c2ccccc2C=C1)C(=O)c1ccccc1

STK582046
Synonyms: 3,4,5- trimethoxy- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (2- methylpropyl)benzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)N(Cc1cc2cc(C)ccc2[nH]c1=O)CC(C)C

STK582048
Synonyms: 4- {[(E)- (2- chloro- 6- fluorophenyl)methylidene]amino}- 5- cyclohexyl- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1cccc(c1/C=N/n1c(=S)[nH]nc1C1CCCCC1)Cl

STK582049
Synonyms: 2- [(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]acetamide
Smiles: NC(=O)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cc(F)cc1

STK582050
Synonyms: 7- (2- chloro- 6- fluorobenzyl)- 8- [(4- ethylpiperazin- 1- yl)methyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCN1CCN(CC1)Cc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C

STK582052
Synonyms: 4- {[(E)- (2,5- dimethoxyphenyl)methylidene]amino}- 5- (2- methoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(c(c1)/C=N/n1c(=S)[nH]nc1c1ccccc1OC)OC

STK582053
Synonyms: 2- (4,6- dimethyl- 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(c2sc3c(n2)c(C)cc(c3)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK582054
Synonyms: N- [6- chloro- 3- (4- methylphenyl)- 4- oxo- 4H- chromen- 2- yl]thiophene- 2- carboxamide
Smiles: Cc1ccc(cc1)c1c(NC(=O)c2cccs2)oc2c(c1=O)cc(cc2)Cl

STK582055
Synonyms: 2- {[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4- difluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1F)F)CSc1nnc(n1C)c1cccc(c1)Cl

STK582057
Synonyms: 3- (2- methyl- 1H- benzimidazol- 1- yl)- N- (quinolin- 3- yl)propanamide
Smiles: O=C(Nc1cnc2c(c1)cccc2)CCn1c(C)nc2c1cccc2

STK582059
Synonyms: 1- (3- fluorophenyl)- 2- (2- hydroxyethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: OCCN1C(=O)c2c(C1c1cccc(c1)F)c(=O)c1c(o2)cccc1

STK582060
Synonyms: (2S)- N- (3- fluorophenyl)- 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanamide
Smiles: Fc1cccc(c1)NC(=O)[C@@H](n1nnc2c(c1=O)cccc2)C

STK582063
Synonyms: methyl[8- (2- methoxyphenyl)- 1- methyl- 2,4- dioxo- 1,2,4,6,7,8- hexahydro- 3H- imidazo[2,1- f]purin- 3- yl]acetate
Smiles: COC(=O)Cn1c(=O)c2n3CCN(c3nc2n(c1=O)C)c1ccccc1OC

STK582064
Synonyms: 6- hydroxy- 3- methyl- 8- [(2E)- 2- (4- nitrobenzylidene)hydrazinyl]- 7- nonyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCCCCCCCCn1c(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc2c1c(O)nc(=O)n2C

STK582065
Synonyms: 4- chloro- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (pyridin- 3- ylmethyl)benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N(Cc1cc2cc(C)ccc2[nH]c1=O)Cc1cccnc1

STK582066
Synonyms: ethyl4- [({[4- amino- 5- (2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1[nH]nc2c1CCC2

STK582070
Synonyms: N- (3- chloro- 4- fluorophenyl)- 2- ({5- [(4- methylphenoxy)methyl]- 4- phenyl- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)CSc1nnc(n1c1ccccc1)COc1ccc(cc1)C

STK582072
Synonyms: {[(3,4- dichlorobenzyl)sulfanyl][(4- fluorophenyl)amino]methylidene}propanedinitrile
Smiles: N#CC(=C(Nc1ccc(cc1)F)SCc1ccc(c(c1)Cl)Cl)C#N

STK582073
Synonyms: methylN- [(1E)- 1- (4- hydroxy- 2,6- dioxo- 1- phenyl- 1,6- dihydropyrimidin- 5(2H)- ylidene)propyl]tryptophanate
Smiles: COC(=O)C(Cc1c[nH]c2c1cccc2)N/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1)O)/CC

STK582074
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (2- chloro- 6- fluorophenyl)methylidene]- 5- (4- methylphenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: Cc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1c(F)cccc1Cl

STK582078
Synonyms: (5E)- 3- (4- chlorophenyl)- 5- {1- [(3,3- diphenylpropyl)amino]propylidene}- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)/NCCC(c1ccccc1)c1ccccc1

STK582080
Synonyms: ethyl4- {(Z)- [2- (4- iodophenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}- 2- methoxyphenylcarbonate
Smiles: CCOC(=O)Oc1ccc(cc1OC)/C=C/1\N=C(OC1=O)c1ccc(cc1)I

STK582081
Synonyms: 2- {5- [(2,6- dichlorobenzyl)sulfanyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}pyrazine
Smiles: Cc1ccc(cc1)n1c(nnc1c1cnccn1)SCc1c(Cl)cccc1Cl

STK582082
Synonyms: 8- (3- chlorophenyl)- 11- (4- methoxyphenyl)- 10- methyl- 2- (pyridin- 2- yl)- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccc(cc1)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1ccccn1)c1cccc(c1)Cl

STK582084
Synonyms: 8- (3- chlorophenyl)- 1- methyl- 3- (3- phenylpropyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: Clc1cccc(c1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCCc1ccccc1

STK582085
Synonyms: 2- (6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)- 1- (10H- phenothiazin- 10- yl)ethanone
Smiles: COc1cc2c(cc1OC)CCN(C2C)CC(=O)N1c2ccccc2Sc2c1cccc2

STK582086
Synonyms: (2'S,3S,3'S,10b'R)- 3'- (thiophen- 2- ylcarbonyl)- 2'- [(3,4,5- trimethoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1c(OC)cc(cc1OC)C(=O)[C@@H]1[C@@H](C(=O)c2cccs2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK582087
Synonyms: 7- (2,6- dichlorobenzyl)- 6- hydroxy- 3- methyl- 8- (morpholin- 4- ylmethyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: Clc1cccc(c1Cn1c(CN2CCOCC2)nc2c1c(O)nc(=O)n2C)Cl

STK582089
Synonyms: 4- (4- chlorophenyl)- 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(cc1)Cl

STK582090
Synonyms: 7'- {(E)- [4- hydroxy- 1- (2- methoxyethyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}- 1,3- dimethyl- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- trion
Smiles: COCCN1C(=O)N=C(/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK582092
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK582093
Synonyms: 2- (2,4- dinitrophenoxy)- 9,10- dimethoxy- 6,7- dihydro- 4H- pyrimido[6,1- a]isoquinolin- 4- one
Smiles: COc1cc2CCn3c(c2cc1OC)cc(nc3=O)Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

STK582095
Synonyms: 2- ({4- amino- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- methylphenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccccc1C

STK582096
Synonyms: 4- nitro- 2- {(E)- [2- (5- phenylthieno[2,3- d]pyrimidin- 4- yl)hydrazinylidene]methyl}phenol
Smiles: Oc1ccc(cc1/C=N/Nc1ncnc2c1c(cs2)c1ccccc1)[N+](=O)[O-]

STK582097
Synonyms: 2- {[5- (3- chlorophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK582098
Synonyms: 4- [(1E)- 2- cyano- 3- methoxy- 3- oxoprop- 1- en- 1- yl]- 2- methoxyphenyl4- (2,4- dichlorophenoxy)butanoate
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OC(=O)CCCOc1ccc(cc1Cl)Cl)/C(=O)OC

STK582099
Synonyms: N- [(2Z)- 3- [4- (dimethylamino)phenyl]- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- phenoxyacetamide
Smiles: O=C(/N=C/1\SC2C(N1c1ccc(cc1)N(C)C)CS(=O)(=O)C2)COc1ccccc1

STK582100
Synonyms: 4- (5,9- dimethyl- 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(nn2c(n1)C)c1ccc(cc1)O

STK582101
Synonyms: 3- (4- chlorophenyl)- 7- (4- cyclohexylpiperazin- 1- yl)- 5- methylpyrazolo[1,5- a]pyrimidine
Smiles: Cc1cc(N2CCN(CC2)C2CCCCC2)n2c(n1)c(cn2)c1ccc(cc1)Cl

STK582102
Synonyms: (2S)- N- (3- acetylphenyl)- 3- methyl- 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)butanamide
Smiles: CC([C@H](n1nnc2c(c1=O)cccc2)C(=O)Nc1cccc(c1)C(=O)C)C

STK582103
Synonyms: 5- (3- ethoxyphenyl)- 4- {[(E)- (2- methoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccccc1OC

STK582104
Synonyms: ethyl2- [(4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)amino]- 4- methyl- 5- (phenylcarbamoyl)thiophene- 3- carboxylate
Smiles: CCOC(=O)c1c(sc(c1C)C(=O)Nc1ccccc1)NC1OC(=O)c2c1ccc(c2OC)OC

STK582105
Synonyms: 4- {[(E)- biphenyl- 4- ylmethylidene]amino}- 5- (3- ethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)c1ccccc1

STK582107
Synonyms: 4- {[(E)- (5- bromo- 2- methoxyphenyl)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/c1cc(Br)ccc1OC

STK582109
Synonyms: 5- [3- (benzyloxy)phenyl]- N'- [(E)- naphthalen- 1- ylmethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1cccc(c1)OCc1ccccc1)N/N=C/c1cccc2c1cccc2

STK582111
Synonyms: 4- chloro- N- [(1Z)- 1- {1- cyano- 2- [(3- methylbutyl)amino]- 2- oxoethylidene}- 1H- isoindol- 3- yl]benzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)Cl)/C(=O)NCCC(C)C

STK582113
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 2- ({5- [(4- chlorophenoxy)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)Cl)OC)nnc1COc1ccc(cc1)Cl

STK582115
Synonyms: 2- chloro- N'- {(1E)- 1- [4- hydroxy- 1- (4- methylphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]ethyl}benzohydrazide
Smiles: Cc1ccc(cc1)N1C(=O)N=C(/C(=C(\NNC(=O)c2ccccc2Cl)/C)/C1=O)O

STK582116
Synonyms: N- [(2E)- 5- {[2- (9H- fluoren- 2- yl)- 2- oxoethyl]sulfanyl}- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: CC(=O)/N=c/1\[nH]nc(s1)SCC(=O)c1ccc2c(c1)Cc1c2cccc1

STK582117
Synonyms: 8- (4- benzylpiperidin- 1- yl)- 6- hydroxy- 3- methyl- 7- (2- oxopropyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(=O)Cn1c(nc2c1c(O)nc(=O)n2C)N1CCC(CC1)Cc1ccccc1

STK582118
Synonyms: N- (3- chlorophenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)Cl)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK582119
Synonyms: 2- hydroxy- N'- {(1Z)- 1- [4- hydroxy- 1- (4- methylphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]ethyl}benzohydrazide
Smiles: Cc1ccc(cc1)N1C(=O)N=C(/C(=C(/NNC(=O)c2ccccc2O)\C)/C1=O)O

STK582120
Synonyms: 2- ethoxy- 4- {(E)- [2- (7- ethyl- 6- hydroxy- 3- methyl- 2- oxo- 3,7- dihydro- 2H- purin- 9- ium- 8- yl)hydrazinylidene]methyl}phenolate
Smiles: CCOc1cc(/C=N/Nc2[nH+]c3c(n2CC)c(O)nc(=O)n3C)ccc1[O-]

STK582121
Synonyms: N- [5- (acetylamino)- 2- methoxyphenyl]- 2- {[4- ethyl- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(n1CC)c1cccc(c1)C)NC(=O)C

STK582122
Synonyms: N- (4- chlorophenyl)- 2- {[5- (3- chlorophenyl)- 4- (4- chlorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK582124
Synonyms: 4- [(4- bromobenzyl)sulfanyl]- 2- (4- butoxyphenyl)- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CCCCOc1ccc(cc1)c1nc(SCc2ccc(cc2)Br)c2c(n1)sc1c2CC(OC1)(C)C

STK582125
Synonyms: N- [2- (4- chlorophenyl)- 6- methyl- 5- oxo- 4- phenyl- 2,5- dihydropyridazin- 3- yl]- 2- methylpropanamide
Smiles: O=C(C(C)C)Nc1c(c2ccccc2)c(=O)c(nn1c1ccc(cc1)Cl)C

STK582126
Synonyms: (4E)- 1- {5- [(2- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}- 5- (3,4- diethoxyphenyl)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]pyrrolidine- 2,3- dione
Smiles: CCOc1cc(ccc1OCC)C1N(c2nnc(s2)SCc2ccccc2Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK582129
Synonyms: 3- (2- methyl- 1H- benzimidazol- 1- yl)- N- (quinolin- 6- yl)propanamide
Smiles: O=C(Nc1ccc2c(c1)cccn2)CCn1c(C)nc2c1cccc2

STK582131
Synonyms: 5- [5- (4- methoxyphenyl)- 1- {[(4- methoxyphenyl)amino]acetyl}pyrazolidin- 3- ylidene]- 1,3- dimethylpyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: COc1ccc(cc1)NCC(=O)N1NC(=C2C(=O)N(C)C(=O)N(C2=O)C)CC1c1ccc(cc1)OC

STK582137
Synonyms: N- (2- cyclohexyl- 1,2,3,4- tetrahydropyrazino[1,2- a]benzimidazol- 8- yl)- 3- methylbutanamide
Smiles: CC(CC(=O)Nc1ccc2c(c1)nc1n2CCN(C1)C1CCCCC1)C

STK582138
Synonyms: 8- (3- chlorophenyl)- 1,3- dimethyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: Clc1cccc(c1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)C

STK582139
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,5- dichlorophenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(Cl)ccc2Cl)nnc1COc1ccc(cc1)Cl

STK582140
Synonyms: N- (3,4- dimethoxyphenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CSc1nnc(n1Cc1ccco1)Cc1cccs1

STK582141
Synonyms: 8- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 7- (3- methylbenzyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1Cc1cccc(c1)C)c(=O)n(c(=O)n2C)C

STK582142
Synonyms: (5E)- 5- {1- [(3,5- dimethoxybenzyl)amino]propylidene}- 6- hydroxy- 3- (2- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O)/NCc1cc(OC)cc(c1)OC

STK582143
Synonyms: 3- (3- bromo- 4- fluorophenyl)- 5- (2- fluorophenyl)- 2- phenyldihydro- 2H- pyrrolo[3,4- d][1,2]oxazole- 4,6(3H,5H)- dione
Smiles: Fc1ccccc1N1C(=O)C2C(C1=O)ON(C2c1ccc(c(c1)Br)F)c1ccccc1

STK582144
Synonyms: 3- [1- (azepan- 1- yl)- 1- oxobutan- 2- yl]quinazolin- 4(3H)- one
Smiles: CCC(n1cnc2c(c1=O)cccc2)C(=O)N1CCCCCC1

STK582145
Synonyms: N'- [3- (2,2- dimethyltetrahydro- 2H- pyran- 4- yl)- 3- (4- methylphenyl)propyl]- N,N- diethylpropane- 1,3- diamine
Smiles: CCN(CCCNCCC(c1ccc(cc1)C)C1CCOC(C1)(C)C)CC

STK582146
Synonyms: 5- hydroxy- 4- (4- methylphenyl)- 2- (methylsulfanyl)- 4,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: CSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1ccc(cc1)C

STK582147
Synonyms: 2- (4- benzyl- 7- chloro- 2,3- dioxo- 3,4- dihydroquinoxalin- 1(2H)- yl)- N- (4,5- dimethyl- 2- nitrophenyl)acetamide
Smiles: O=C(Cn1c(=O)c(=O)n(c2c1cc(Cl)cc2)Cc1ccccc1)Nc1cc(C)c(cc1[N+](=O)[O-])C

STK582149
Synonyms: 8- methoxy- 5- (2- methylpropyl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinoline
Smiles: COc1ncnc2c1oc1c2c2CCCCc2c(n1)CC(C)C

STK582150
Synonyms: 2,6- dichloro- N- [2- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)ethyl]pyridine- 4- carboxamide
Smiles: Clc1nc(Cl)cc(c1)C(=O)NCCc1nnc2n1cccc2

STK582151
Synonyms: 5- {[1- (2- chlorobenzyl)- 2,3- dihydro- 1H- indol- 5- yl]methylidene}- 1,3- diphenyl- 2- thioxodihydropyrimidine- 4,6(1H,5H)- dione
Smiles: S=C1N(c2ccccc2)C(=O)/C(=C/c2ccc3c(c2)CCN3Cc2ccccc2Cl)/C(=O)N1c1ccccc1

STK582153
Synonyms: 1- (3- chlorophenyl)- 7- ethyl- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1cccc(c1)Cl)c1noc(c1)C

STK582154
Synonyms: 8- (4- ethylpiperazin- 1- yl)- 2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: CCN1CCN(CC1)c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C

STK582155
Synonyms: (4E)- 5- (3- fluorophenyl)- 4- [hydroxy(4- methylphenyl)methylidene]- 1- [3- (trifluoromethyl)phenyl]pyrrolidine- 2,3- dione
Smiles: Fc1cccc(c1)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1c1cccc(c1)C(F)(F)F

STK582156
Synonyms: 1- (3,4- dimethylphenyl)- 2- hydroxy- 6- (1- phenylethyl)- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(O)n(c2c1CN(CN2)C(c1ccccc1)C)c1ccc(c(c1)C)C

STK582157
Synonyms: (3a'S,6a'R)- 5- chloro- 3'- (4- hydroxybenzyl)- 5'- (2- methoxyethyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cc(Cl)cc2

STK582159
Synonyms: N- (3,5- dimethylphenyl)- 2- {[5- (3- methoxyphenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)cc(c2)C)nnc1c1cccc(c1)OC

STK582160
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OC)COc1ccc(cc1)Cl

STK582161
Synonyms: N- [4- chloro- 3- (trifluoromethyl)phenyl]- 2- (6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)acetamide
Smiles: COc1cc2CCN(C(c2cc1OC)C)CC(=O)Nc1ccc(c(c1)C(F)(F)F)Cl

STK582162
Synonyms: N- {[trans- 4- ({[N- (tert- butoxycarbonyl)- D- valyl]amino}methyl)cyclohexyl]carbonyl}- L- leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)[C@@H]1CC[C@H](CC1)CNC(=O)[C@@H](C(C)C)NC(=O)OC(C)(C)C)C

STK582163
Synonyms: N- [4- (4- chlorophenyl)- 6- methyl- 5- oxo- 2- phenyl- 2,5- dihydropyridazin- 3- yl]cyclohexanecarboxamide
Smiles: Clc1ccc(cc1)c1c(=O)c(C)nn(c1NC(=O)C1CCCCC1)c1ccccc1

STK582164
Synonyms: 3- (7- methoxy- 4,8- dimethyl- 2- oxo- 2H- chromen- 3- yl)- N- (2,2,6,6- tetramethylpiperidin- 4- yl)propanamide
Smiles: COc1ccc2c(c1C)oc(=O)c(c2C)CCC(=O)NC1CC(C)(C)NC(C1)(C)C

STK582165
Synonyms: 2- [5- hydroxy- 2- (4- methoxyphenyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1ccc(cc1)c1nn2c(n1)nc(cc2N1C(=O)c2c(C1=O)cccc2)O

STK582166
Synonyms: N- [(2Z)- 3- (2,4- difluorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- methylpropanamide
Smiles: Fc1ccc(c(c1)F)N1/C(=N/C(=O)C(C)C)/SC2C1CS(=O)(=O)C2

STK582168
Synonyms: (3a'S,6a'R)- 5- fluoro- 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)Nc2c1cc(F)cc2

STK582169
Synonyms: 2,3- dihydro- 1H- imidazo[1,2- a]benzimidazol- 1- yl(5- fluoro- 1H- indol- 2- yl)methanone
Smiles: Fc1ccc2c(c1)cc([nH]2)C(=O)N1CCn2c1nc1c2cccc1

STK582170
Synonyms: (4E)- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 5- (5- methylfuran- 2- yl)- 1- (2- phenylethyl)pyrrolidine- 2,3- dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccc(o1)C)CCc1ccccc1)/O

STK582171
Synonyms: 1'- cyclohexyl- 2'- hydroxy- 3- methyl- 8- nitro- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrido[1,2- a]quinoline- 5,5'- pyrimidine]- 4',6'(1'H)- dione
Smiles: CC1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N=C(N(C1=O)C1CCCCC1)O

STK582172
Synonyms: Nalpha- ({1- [N- (tert- butoxycarbonyl)- L- alanyl]piperidin- 4- yl}carbonyl)- N- (4- methoxybenzyl)- L- phenylalaninamide
Smiles: COc1ccc(cc1)CNC(=O)[C@H](Cc1ccccc1)NC(=O)C1CCN(CC1)C(=O)[C@@H](NC(=O)OC(C)(C)C)C

STK582173
Synonyms: N- [3- (3- chlorophenyl)- 4- oxo- 4H- chromen- 2- yl]cyclohexanecarboxamide
Smiles: Clc1cccc(c1)c1c(NC(=O)C2CCCCC2)oc2c(c1=O)cccc2

STK582174
Synonyms: N- [(2E)- 1,3- benzothiazol- 2(3H)- ylidene]- 6- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)hexanamide
Smiles: O=C(/N=c\1/sc2c([nH]1)cccc2)CCCCCn1nnc2c(c1=O)cccc2

STK582178
Synonyms: (4Z)- 2- (3- chlorophenyl)- 4- [2- (thiophen- 2- yl)- 4H- chromen- 4- ylidene]- 1,3- oxazol- 5(4H)- one
Smiles: Clc1cccc(c1)C1=N/C(=C\2/C=C(Oc3c2cccc3)c2cccs2)/C(=O)O1

STK582179
Synonyms: N- (3,5- dichlorophenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)cc(c1)Cl)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C

STK582183
Synonyms: N- (4- fluorophenyl)- 2- {[5- (3- methylphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)F)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C

STK582187
Synonyms: [4- (4- fluorophenyl)piperazin- 1- yl](4,5,6- trimethoxy- 1H- indol- 2- yl)methanone
Smiles: COc1cc2[nH]c(cc2c(c1OC)OC)C(=O)N1CCN(CC1)c1ccc(cc1)F

STK582188
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,6- dimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cccc1C)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK582189
Synonyms: N- {(2S)- 3- methyl- 1- oxo- 1- [(3- phenylpropyl)amino]butan- 2- yl}- 2,3- dihydro- 1H- imidazo[1,2- a]benzimidazole- 1- carboxamide
Smiles: CC([C@@H](C(=O)NCCCc1ccccc1)NC(=O)N1CCn2c1nc1c2cccc1)C

STK582191
Synonyms: N- (3,5- dimethylphenyl)- 2- {[5- (2- fluorophenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)cc(c2)C)nnc1c1ccccc1F

STK582192
Synonyms: N- (2,3- dimethylphenyl)- 2- {[4- (4- methylphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1C)C)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK582193
Synonyms: 1'- benzyl- 2'- hydroxy- 3- methyl- 8- nitro- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 4',6'(1'H)- dione
Smiles: CN1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N=C(N(C1=O)Cc1ccccc1)O

STK582194
Synonyms: 4- {[(2Z)- 3- (4- bromo- 2- chlorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]amino}- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)/N=C/1\SC2C(N1c1ccc(cc1Cl)Br)CS(=O)(=O)C2

STK582195
Synonyms: (2Z)- N- (2- chlorophenyl)- 4- hydroxy- 2- [(2E)- (4- methoxybenzylidene)hydrazinylidene]- 5,6- dihydro- 2H- 1,3- thiazine- 6- carboxamide
Smiles: COc1ccc(cc1)/C=N/N=C\1/N=C(O)CC(S1)C(=O)Nc1ccccc1Cl

STK582196
Synonyms: 6- (4- methoxyphenyl)- 2- methyl- 9- (3,4,5- trimethoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2cc(OC)c(c(c2)OC)OC)nc(n3)C)C1)O

STK582197
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(4- fluorophenyl)carbonyl]- 3'- [(4- methoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)F)C(=O)Nc1c2cccc1)cccc3

STK582198
Synonyms: 7- (4- fluorobenzyl)- 10- methoxy- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 6(7H)- one
Smiles: COc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2Cc1ccc(cc1)F

STK582199
Synonyms: 8- cyclohexyl- 1,6,7- trimethyl- 3- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: O=c1n(CCN2CCCCC2)c(=O)n(c2c1n1c(n2)n(c(c1C)C)C1CCCCC1)C

STK582200
Synonyms: (3S)- N- [(1R)- 2- (cyclohexylamino)- 2- oxo- 1- phenylethyl]- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: O=C([C@@H](c1ccccc1)NC(=O)[C@H]1NCc2c(C1)cccc2)NC1CCCCC1

STK582202
Synonyms: 8- (3- chlorophenyl)- 4- hydroxy- 1,6,7- trimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Clc1cccc(c1)n1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK582204
Synonyms: N- [4- (diethylamino)phenyl]- 2- {[4- (4- methylphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1)CC

STK582205
Synonyms: N- (4- chloro- 2- methoxy- 3- methylphenyl)- 2- {[4- (4- chlorophenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1c(ccc(c1C)Cl)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)C

STK582207
Synonyms: 2- oxo- 7- phenyl- 4- ({[3- (trifluoromethyl)phenyl]ammonio}methyl)- 2H- chromen- 6- olate
Smiles: O=c1cc(C[NH2+]c2cccc(c2)C(F)(F)F)c2c(o1)cc(c(c2)[O-])c1ccccc1

STK582208
Synonyms: (4E)- 5- [4- (benzyloxy)- 3- methoxyphenyl]- 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: COc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)C

STK582209
Synonyms: 6- methyl- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- yl2- {[(4- methylphenyl)sulfonyl]amino}butanoate
Smiles: CCC(C(=O)Oc1ccc2c(c1C)oc(=O)c1c2CCC1)NS(=O)(=O)c1ccc(cc1)C

STK582210
Synonyms: N- {2- [2- (4- ethylpiperazin- 1- yl)ethyl]- 1- methyl- 1H- benzimidazol- 5- yl}benzamide
Smiles: CCN1CCN(CC1)CCc1nc2c(n1C)ccc(c2)NC(=O)c1ccccc1

STK582213
Synonyms: N- (2,4- dimethylphenyl)- 6,7- dimethoxy- 3,4- dihydroisoquinoline- 2(1H)- carbothioamide
Smiles: COc1cc2CN(CCc2cc1OC)C(=S)Nc1ccc(cc1C)C

STK582214
Synonyms: N- (4- ethoxyphenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK582215
Synonyms: (4E)- 4- [(4- bromophenyl)(hydroxy)methylidene]- 1- (5- tert- butyl- 1,2- oxazol- 3- yl)- 5- (2- fluorophenyl)pyrrolidine- 2,3- dione
Smiles: Brc1ccc(cc1)/C(=C\1/C(c2ccccc2F)N(C(=O)C1=O)c1noc(c1)C(C)(C)C)/O

STK582216
Synonyms: N- [4- (acetylamino)phenyl]- 6- (4- oxoquinazolin- 3(4H)- yl)hexanamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CCCCCn1cnc2c(c1=O)cccc2

STK582217
Synonyms: [1- (4- methylphenyl)- 4- [(4- methylphenyl)amino]- 2- (3- nitrophenyl)- 5- oxo- 2,5- dihydro- 1H- pyrrol- 3- yl]aceticacid
Smiles: Cc1ccc(cc1)NC1=C(CC(=O)O)C(N(C1=O)c1ccc(cc1)C)c1cccc(c1)[N+](=O)[O-]

STK582221
Synonyms: 4- [2- (furan- 2- yl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- yl]- N,N- dimethylaniline
Smiles: Cc1nn(c2c1C(c1ccc(cc1)N(C)C)c1c(O2)ncn2c1nc(n2)c1ccco1)c1ccccc1

STK582223
Synonyms: 2- {[4- amino- 5- (2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (5- bromopyridin- 2- yl)acetamide
Smiles: O=C(Nc1ccc(cn1)Br)CSc1nnc(n1N)c1[nH]nc2c1CCC2

STK582224
Synonyms: 4- {[(E)- (3- methoxyphenyl)methylidene]amino}- 5- [3- (propan- 2- yloxy)phenyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)OC(C)C

STK582225
Synonyms: 1- {1- [6- (2- fluorophenoxy)- 2- phenylpyrimidin- 4- yl]- 5- methyl- 1H- pyrazol- 4- yl}ethanone
Smiles: CC(=O)c1cnn(c1C)c1cc(nc(n1)c1ccccc1)Oc1ccccc1F

STK582227
Synonyms: N- [4- (diethylamino)phenyl]- 2- {[4- phenyl- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)c1cnccn1)CC

STK582228
Synonyms: 1',3,3'- trimethyl- 8- nitro- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: CN1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)N(C)C(=O)N(C1=O)C

STK582229
Synonyms: 5- [2- (benzyloxy)phenyl]- N'- {(E)- [4- (propan- 2- yl)phenyl]methylidene}- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccccc1OCc1ccccc1)N/N=C/c1ccc(cc1)C(C)C

STK582230
Synonyms: 4- (2- chlorophenyl)- 5- [3- (furan- 2- yl)- 1H- pyrazol- 5- yl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1c1ccccc1Cl)c1[nH]nc(c1)c1ccco1

STK582231
Synonyms: 7- [2- hydroxy- 3- (3- methylphenoxy)propyl]- 1,3- dimethyl- 8- (morpholin- 4- yl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Cc1cccc(c1)OCC(Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCOCC1)O

STK582232
Synonyms: (E)- {4- [(3- methylbenzyl)oxy]phenyl}[2- (4- nitrophenyl)- 4,5- dioxo- 1- (pyridinium- 4- ylmethyl)pyrrolidin- 3- ylidene]methanolate
Smiles: Cc1cccc(c1)COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])Cc1cc[nH+]cc1)/[O-]

STK582233
Synonyms: N- [(3Z)- 7- methyl- 1- (2- methylpropyl)- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 4- nitrobenzenesulfonamide
Smiles: CC(Cn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])/c2c1nc1cc(C)ccc1c2)C

STK582234
Synonyms: 3,6- diamino- N- (3- chlorophenyl)- 5- cyanothieno[2,3- b]pyridine- 2- carboxamide
Smiles: N#Cc1cc2c(nc1N)sc(c2N)C(=O)Nc1cccc(c1)Cl

STK582236
Synonyms: N- (3- fluorophenyl)- 2- {[5- (2- fluorophenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)F)nnc1c1ccccc1F

STK582237
Synonyms: N- [(2E)- 3- (3- chlorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- methoxyacetamide
Smiles: COCC(=O)/N=C\1/SC2C(N1c1cccc(c1)Cl)CS(=O)(=O)C2

STK582241
Synonyms: N- [2- (4- chlorophenyl)- 6- methyl- 5- oxo- 4- phenyl- 2,5- dihydropyridazin- 3- yl]furan- 2- carboxamide
Smiles: Clc1ccc(cc1)n1nc(C)c(=O)c(c1NC(=O)c1ccco1)c1ccccc1

STK582242
Synonyms: N'- {(1Z)- 1- [4- hydroxy- 1- (2- methylphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]ethyl}benzohydrazide
Smiles: C/C(=C/1\C(=NC(=O)N(C1=O)c1ccccc1C)O)/NNC(=O)c1ccccc1

STK582243
Synonyms: (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)(1,2,3,4- tetrahydroacridin- 9- yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1c2CCCCc2nc2c1cccc2

STK582244
Synonyms: 3- chloro- 4- [(4- ethylphenyl)amino]- 1- (naphthalen- 1- yl)- 1H- pyrrole- 2,5- dione
Smiles: CCc1ccc(cc1)NC1=C(Cl)C(=O)N(C1=O)c1cccc2c1cccc2

STK582248
Synonyms: (4E)- 4- {[(2- hydroxyethyl)amino]methylidene}- 2- (4- methylphenyl)isoquinoline- 1,3(2H,4H)- dione
Smiles: OCCN/C=C\1/C(=O)N(c2ccc(cc2)C)C(=O)c2c1cccc2

STK582250
Synonyms: N- [4- (butan- 2- yl)phenyl]- 2- {[4- (4- methylphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1)C

STK582251
Synonyms: 6- (2- chloro- 5- nitrophenyl)- 6H- benzo[b]indeno[1,2- e][1,4]thiazepin- 5- ol
Smiles: Clc1ccc(cc1C1Sc2ccccc2N=C2C1=C(O)c1c2cccc1)[N+](=O)[O-]

STK582252
Synonyms: N- (4- methylbenzyl)- 1- [2- (piperidin- 1- yl)ethyl]- 1H- benzimidazol- 2- amine
Smiles: Cc1ccc(cc1)CNc1nc2c(n1CCN1CCCCC1)cccc2

STK582254
Synonyms: (4E)- 4- (dibenzo[b,d]furan- 2- ylmethylidene)- 2- (thiophen- 2- yl)- 1,3- oxazol- 5(4H)- one
Smiles: O=C1OC(=N/C/1=C/c1ccc2c(c1)c1ccccc1o2)c1cccs1

STK582255
Synonyms: ethyl5- methoxy- 3- {[(2- methoxy- 5- methylphenyl)sulfonyl]amino}- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NS(=O)(=O)c1cc(C)ccc1OC)cc(cc2)OC

STK582256
Synonyms: 8- chloro- N- (3- chlorophenyl)[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: Clc1cccc(c1)Nc1ncnc2c1oc1c2cc(cc1)Cl

STK582257
Synonyms: 11- (3- bromophenyl)- 10- methyl- 8- (4- nitrophenyl)- 8,11- dihydropyrazolo[3',4':4,5]pyrimido[1,2- a]quinoxalin- 6(5H)- one
Smiles: Brc1cccc(c1)C1c2c(C)nn(c2N=c2n1c1ccccc1[nH]c2=O)c1ccc(cc1)[N+](=O)[O-]

STK582259
Synonyms: 2- chloro- N- [(2Z)- 5- ({2- [(2,6- diethylphenyl)amino]- 2- oxoethyl}sulfanyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]benzamide
Smiles: CCc1cccc(c1NC(=O)CSc1n[nH]/c(=N/C(=O)c2ccccc2Cl)/s1)CC

STK582261
Synonyms: (5- ethyl- 1- hydroxy- 2- methyl- 3- oxido- 4- phenyl- 2,5- dihydro- 1H- imidazol- 2- yl)(4- methoxyphenyl)methanone
Smiles: CCC1N(O)C([N+](=C1c1ccccc1)[O-])(C)C(=O)c1ccc(cc1)OC

STK582262
Synonyms: N- (2- bromophenyl)- 2- {[4- (4- methoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2Br)nnc1c1cccc(c1)C

STK582263
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- ethyl- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- phenoxyphenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)Oc2ccccc2)nnc1COc1ccc(cc1)Cl

STK582264
Synonyms: 1- (4- chlorophenyl)- 2- ({4- (4- ethoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)ethanone
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nnc1COc1ccc(cc1)C

STK582265
Synonyms: 4- ({(E)- [3- (benzyloxy)- 4- methoxyphenyl]methylidene}amino)- 5- (2- chlorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1OCc1ccccc1)/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

STK582266
Synonyms: (4E)- 1- benzyl- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 5- (5- methylfuran- 2- yl)pyrrolidine- 2,3- dione
Smiles: Cc1ccc(o1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1Cc1ccccc1

STK582267
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)- 3- (4- chlorophenyl)- 6- methyl- 4a,7a,8,8a- tetrahydro- 3aH- 4,8- methano[1,2]oxazolo[4,5- f]isoindole- 5,7(4H,6H)- dione
Smiles: Clc1ccc(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

STK582269
Synonyms: (5Z)- 5- {[1- (1,3- benzodioxol- 5- yl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]methylidene}- 3- (4- fluorobenzyl)- 2- hydroxy- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: Fc1ccc(cc1)CN1C(=N/C(=C\c2cc(n(c2C)c2ccc3c(c2)OCO3)C)/C1=O)O

STK582270
Synonyms: 4- [(2E)- 2- (2,3- dichlorobenzylidene)hydrazinyl]- 5- (4- ethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1N/N=C/c1cccc(c1Cl)Cl

STK582272
Synonyms: 8- (4- methoxyphenyl)- 1,7- dimethyl- 3- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COc1ccc(cc1)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK582274
Synonyms: (5Z)- 3- (4- chlorophenyl)- 5- [5- (4- ethoxyphenyl)pyrazolidin- 3- ylidene]- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CCOc1ccc(cc1)C1NN/C(=C\2/C(=NC(=O)N(C2=O)c2ccc(cc2)Cl)O)/C1

STK582275
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,5- dimethylphenyl)acetamide
Smiles: O=C(Nc1cc(C)cc(c1)C)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK582276
Synonyms: N- [4- (4- chlorophenyl)- 6- methyl- 2- (4- methylphenyl)- 5- oxo- 2,5- dihydropyridazin- 3- yl]cyclohexanecarboxamide
Smiles: Cc1ccc(cc1)n1nc(C)c(=O)c(c1NC(=O)C1CCCCC1)c1ccc(cc1)Cl

STK582277
Synonyms: 1'- (2,2- dimethoxyethyl)- 1- hexyl- 6'- nitro- 1',4'- dihydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinoline]- 2,4,6(1H,3H)- trione
Smiles: CCCCCCN1C(=O)NC(=O)C2(C1=O)CN(CC(OC)OC)c1c(C2)cc(cc1)[N+](=O)[O-]

STK582279
Synonyms: N- (pyridin- 2- ylmethyl)- 2- [(3,4,7- trimethyl- 2- oxo- 2H- chromen- 5- yl)oxy]acetamide
Smiles: O=C(COc1cc(C)cc2c1c(C)c(c(=O)o2)C)NCc1ccccn1

STK582280
Synonyms: 5- (4- chlorophenyl)- 10- (2- hydroxy- 3- methoxyphenyl)- 1,3- dimethyl- 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)Cl)C

STK582281
Synonyms: 5- (4- tert- butylphenyl)- 4- {[(E)- (3- chlorophenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)C(C)(C)C

STK582282
Synonyms: 9- (3,5- dimethylphenyl)- 1- methyl- 3- [2- (piperidin- 1- yl)ethyl]- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: Cc1cc(C)cc(c1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK582283
Synonyms: 3- (3- chlorophenyl)- 4- methyl- 5- [(2- methylbenzyl)sulfanyl]- 4H- 1,2,4- triazole
Smiles: Clc1cccc(c1)c1nnc(n1C)SCc1ccccc1C

STK582284
Synonyms: 1- (3- hydroxyphenyl)- 2- (6- methyl- 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(=O)c2c1c(=O)c1c(o2)cccc1

STK582285
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(4- methylphenyl)carbonyl]- 2'- (pyridin- 2- ylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Cc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccn1)C(=O)Nc1c2cccc1)cccc3

STK582286
Synonyms: (4E)- 2- (3,5- 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)cc(c1)C

STK582288
Synonyms: 4- {(6E)- 5- iminio- 6- [(2- methyl- 1H- indol- 3- yl)methylidene]- 7- oxo- 6,7- dihydro- 5H- [1,3,4]thiadiazolo[3,2- a]pyrimidin- 2- yl}phenolate
Smiles: [O-]c1ccc(cc1)c1nn2c(=NC(=O)/C(=C/c3c(C)[nH]c4c3cccc4)/C2=[NH2+])s1

STK582289
Synonyms: 10- [4- (dimethylamino)phenyl]- 5- (4- methoxyphenyl)- 1,3- dimethyl- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: COc1ccc(cc1)c1c2c(c3n1CCOC3c1ccc(cc1)N(C)C)n(C)c(=O)n(c2=O)C

STK582291
Synonyms: 2- {[4- (4- methylphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [2- (trifluoromethyl)phenyl]acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(F)(F)F)nnc1c1ccccn1

STK582294
Synonyms: N- (3- methylphenyl)- 2- (10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidin- 7- ylsulfanyl)acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nnc2n1c1sc3c(c1c1n2ncn1)CCCC3

STK582296
Synonyms: 5- (3- ethoxyphenyl)- 4- ({(E)- [4- (trifluoromethyl)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(F)(F)F

STK582297
Synonyms: (5E)- 3- (4- ethylphenyl)- 6- hydroxy- 5- [(piperidin- 1- ylamino)methylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: CCc1ccc(cc1)N1C(=O)N=C(/C(=C\NN2CCCCC2)/C1=O)O

STK582298
Synonyms: 4- [11- (2- methoxyphenyl)- 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]- N,N- dimethylaniline
Smiles: COc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1ccc(cc1)N(C)C)c1ccccc1

STK582301
Synonyms: 1- amino- 8,8- dimethyl- N- (pyridin- 2- yl)- 5- (pyrrolidin- 1- yl)- 8,9- dihydro- 6H- pyrano[4,3- d]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCCC1)Nc1ccccn1

STK582303
Synonyms: 4- methoxy- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (2- methylpropyl)benzamide
Smiles: COc1ccc(cc1)C(=O)N(Cc1cc2ccc(cc2[nH]c1=O)C)CC(C)C

STK582304
Synonyms: 5- chloro- N- (3- methoxypropyl)- 1H- indole- 2- carboxamide
Smiles: COCCCNC(=O)c1cc2c([nH]1)ccc(c2)Cl

STK582306
Synonyms: N- (4- methoxybenzyl)- 2- (6- oxo- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 7(6H)- yl)acetamide
Smiles: COc1ccc(cc1)CNC(=O)Cn1c2ccccc2c2c1c(=O)n1CCCSc1n2

STK582307
Synonyms: 7- (4- fluorobenzyl)- 6- hydroxy- 8- {(2E)- 2- [1- (2- hydroxyphenyl)ethylidene]hydrazinyl}- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Fc1ccc(cc1)Cn1c(N/N=C(/c2ccccc2O)\C)nc2c1c(O)nc(=O)n2C

STK582308
Synonyms: N- [(2Z)- 3- (2,5- dimethoxyphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]cyclohexanecarboxamide
Smiles: COc1ccc(c(c1)N1/C(=N/C(=O)C2CCCCC2)/SC2C1CS(=O)(=O)C2)OC

STK582311
Synonyms: 3- [(Z)- (3- ethyl- 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: CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)c2ccccc2)/C1=O

STK582313
Synonyms: N- [3- (furan- 2- yl)- 6- methylheptyl]- 4- methylcyclohexanamine
Smiles: CC(CCC(c1ccco1)CCNC1CCC(CC1)C)C

STK582314
Synonyms: (4E)- 5- (2,4- dimethoxyphenyl)- 1- hexyl- 4- [hydroxy(4- methylphenyl)methylidene]pyrrolidine- 2,3- dione
Smiles: CCCCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccc(cc1OC)OC

STK582316
Synonyms: 9- (3- hydroxy- 4- methoxyphenyl)- 6- (4- methoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2ccc(c(c2)O)OC)ncn3)C1)O

STK582318
Synonyms: N- [(2Z)- 3- (4- fluorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- methoxyacetamide
Smiles: COCC(=O)/N=C/1\SC2C(N1c1ccc(cc1)F)CS(=O)(=O)C2

STK582324
Synonyms: N- (2,3- dihydroimidazo[2,1- b][1,3]benzothiazol- 6- yl)- 5,6- dimethoxy- 1H- indole- 2- carboxamide
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)Nc1ccc2c(c1)n1CCN=c1s2

STK582327
Synonyms: (5E)- 5- (1- {[2- (4- acetylpiperazin- 1- yl)ethyl]amino}propylidene)- 6- hydroxy- 3- (prop- 2- en- 1- yl)pyrimidine- 2,4(3H,5H)- dione
Smiles: C=CCN1C(=O)N=C(/C(=C(\NCCN2CCN(CC2)C(=O)C)/CC)/C1=O)O

STK582330
Synonyms: 6- (furan- 2- yl)- 2- methyl- 9- (4- methylphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Cc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1nc(n2)C)c1ccco1

STK582331
Synonyms: 2- chloro- 6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 3- yl6- {[(4- methylphenyl)sulfonyl]amino}hexanoate
Smiles: O=C(Oc1cc2oc(=O)c3c(c2cc1Cl)CCCC3)CCCCCNS(=O)(=O)c1ccc(cc1)C

STK582332
Synonyms: methyl4- [2- (6- fluoro- 1,3- benzothiazol- 2- yl)- 3,9- dioxo- 1,2,3,9- tetrahydrochromeno[2,3- c]pyrrol- 1- yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(c2sc3c(n2)ccc(c3)F)C(=O)c2c1c(=O)c1c(o2)cccc1

STK582333
Synonyms: 7- (4- methoxybenzyl)- 8- (pyrrolidin- 1- yl)- 3,4- dihydro- 2H,6H- pyrimido[2,1- b][1,3]thiazin- 6- one
Smiles: COc1ccc(cc1)Cc1c(nc2n(c1=O)CCCS2)N1CCCC1

STK582334
Synonyms: methylN- [(3- methoxyphenyl)carbamoyl]- D- methioninate
Smiles: CSCC[C@H](C(=O)OC)NC(=O)Nc1cccc(c1)OC

STK582335
Synonyms: propyl[(2,5- dimethoxyphenyl)(hydroxy)methyl][4- (dimethylamino)phenyl]phosphinate
Smiles: CCCOP(=O)(C(c1cc(OC)ccc1OC)O)c1ccc(cc1)N(C)C

STK582336
Synonyms: methyl4- {[(3- methyl- 4- oxo- 4,5,6,7- tetrahydro- 1- benzofuran- 2- yl)carbonyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)c1oc2c(c1C)C(=O)CCC2

STK582337
Synonyms: 2- [(1,3- benzothiazol- 2- ylsulfanyl)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: Cc1nn(c2c1C(c1cccnc1)c1c(O2)ncn2c1nc(n2)CSc1nc2c(s1)cccc2)c1ccccc1

STK582339
Synonyms: 2- (ethylsulfanyl)- 5- methyl- 6- pentyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCCCCc1c(C)nc2n(c1O)nc(n2)SCC

STK582340
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- {[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1C)c1cccc(c1)Cl

STK582341
Synonyms: 4- bromo- N- [(2E)- 6- methoxy- 1,3- benzothiazol- 2(3H)- ylidene]benzamide
Smiles: COc1ccc2c(c1)s/c(=N/C(=O)c1ccc(cc1)Br)/[nH]2

STK582342
Synonyms: 1,1',3'- trimethyl- 2- phenyl- 2H,2'H,4H- spiro[dipyrido[1,2- a:2',3'- d]pyrimidine- 3,5'- pyrimidine]- 2',4',5,6'(1H,1'H,3'H)- tetrone
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1c(N(C2c2ccccc2)C)nc2n(c1=O)cccc2

STK582343
Synonyms: 6'- hydroxy- 2,4- dimethyl- 8- nitro- 3'- (propan- 2- yl)- 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)C(C)C)O)[N+](=O)[O-]

STK582344
Synonyms: 4- fluoro- N- [2- (2- phenylethyl)- 1,2,3,4- tetrahydropyrazino[1,2- a]benzimidazol- 8- yl]benzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1ccc2c(c1)nc1n2CCN(C1)CCc1ccccc1

STK582345
Synonyms: N- (2- ethylphenyl)- 2- {[4- (4- methoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1cccc(c1)C

STK582346
Synonyms: N- [4- ({(1E)- 1- [4- hydroxy- 1- (2- methylphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]propyl}amino)phenyl]acetamide
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O)/Nc1ccc(cc1)NC(=O)C

STK582347
Synonyms: (5E)- 5- [(1- benzyl- 1,2,3,4- tetrahydroquinolin- 6- yl)methylidene]- 6- hydroxy- 3- (4- iodophenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: Ic1ccc(cc1)N1C(=O)N=C(/C(=C\c2ccc3c(c2)CCCN3Cc2ccccc2)/C1=O)O

STK582348
Synonyms: 3- methoxy- N- [(3Z)- 1- propyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]propanamide
Smiles: CCCn1[nH]/c(=N\C(=O)CCOC)/c2c1nc1ccccc1c2

STK582349
Synonyms: 2- [(2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 2- ylmethyl)propanamide
Smiles: O=C(C(Oc1ccc2c(c1)oc(=O)cc2)C)NCc1ccccn1

STK582351
Synonyms: methyl2- ({(E)- [2- (3,4- dimethylphenyl)- 1,3- dioxo- 2,3- dihydroisoquinolin- 4(1H)- ylidene]methyl}amino)benzoate
Smiles: COC(=O)c1ccccc1N/C=C\1/C(=O)N(c2ccc(c(c2)C)C)C(=O)c2c1cccc2

STK582352
Synonyms: N- (2,4- dimethylphenyl)- 2- {[4- (4- methylphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C)C)nnc1Cc1cccs1

STK582353
Synonyms: 6- {[(4- chlorophenyl)sulfanyl]methyl}- 2- (3,4- dihydroisoquinolin- 2(1H)- yl)pyrimidin- 4- ol
Smiles: Clc1ccc(cc1)SCc1cc(O)nc(n1)N1CCc2c(C1)cccc2

STK582356
Synonyms: N- [(2Z)- 3- (4- chlorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]propanamide
Smiles: CCC(=O)/N=C/1\SC2C(N1c1ccc(cc1)Cl)CS(=O)(=O)C2

STK582357
Synonyms: 2- {[7,7- dimethyl- 2- (4- methylphenyl)- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}- 1- (pyrrolidin- 1- yl)ethanone
Smiles: Cc1ccc(cc1)c1nc(SCC(=O)N2CCCC2)c2c(n1)CC(OC2)(C)C

STK582359
Synonyms: 6- benzyl- 1- (furan- 2- ylmethyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(S)n(c2c1CN(CN2)Cc1ccccc1)Cc1ccco1

STK582361
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- fluorophenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)F)nnc1c1cccc(c1)Cl

STK582362
Synonyms: 6- (furan- 2- yl)- 2- methyl- 4- (4- methylphenyl)pyridazino[3',4':4,5]pyrimido[1,6- a]benzimidazol- 1(4H)- one
Smiles: Cc1ccc(cc1)n1nc(C)c(=O)c2c1nc(c1ccco1)n1c2nc2c1cccc2

STK582364
Synonyms: 2- {[2- (morpholin- 4- yl)ethyl]amino}- 3- (2- phenylethyl)- 3,5,6,7,8,9- hexahydro- 4H- cyclohepta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: O=c1c2c(sc3c2CCCCC3)nc(n1CCc1ccccc1)NCCN1CCOCC1

STK582365
Synonyms: 4- {[(E)- (3- bromo- 4- methoxyphenyl)methylidene]amino}- 5- (pyridin- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1Br)/C=N/n1c(=S)[nH]nc1c1ccccn1

STK582367
Synonyms: N- (3- chlorophenyl)- 2- (3- oxo- 2,3- dihydro- 1H- isoindol- 1- yl)acetamide
Smiles: O=C(CC1NC(=O)c2c1cccc2)Nc1cccc(c1)Cl

STK582369
Synonyms: 6- ethyl- 6- methyl- 2- {[2- (morpholin- 4- yl)ethyl]sulfanyl}- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CCC1(C)OCc2c(C1)c1c(N)nc(nc1s2)SCCN1CCOCC1

STK582371
Synonyms: (2R)- ({N- [(4- methyl- 2- oxo- 6,7,8,9- tetrahydro- 2H- [1]benzofuro[3,2- g]chromen- 3- yl)acetyl]- D- isoleucyl}amino)(phenyl)ethanoicacid
Smiles: CC[C@H]([C@H](C(=O)N[C@H](c1ccccc1)C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2)C

STK582372
Synonyms: (4E)- 1- (5- acetyl- 4- methyl- 1,3- thiazol- 2- yl)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- (2- fluorophenyl)pyrrolidine- 2,3- dione
Smiles: O/C(=C/1\C(c2ccccc2F)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)C)/c1ccc2c(c1)OCCO2

STK582373
Synonyms: 1- (4- ethylphenyl)- N- (3- methoxyphenyl)- 4- (4- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1cccc(c1)OC)cc3c1ccc(cc1)C

STK582374
Synonyms: (2Z)- 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 1(2H)- ylidene)- 1- [4- (trifluoromethoxy)phenyl]ethanone
Smiles: COc1cc2/C(=C/C(=O)c3ccc(cc3)OC(F)(F)F)/NCCc2cc1OC

STK582376
Synonyms: N'- [(E)- (3- hydroxy- 4- methoxyphenyl)methylidene]- 5- methoxy- 1H- indole- 2- carbohydrazide
Smiles: COc1ccc2c(c1)cc([nH]2)C(=O)N/N=C/c1ccc(c(c1)O)OC

STK582378
Synonyms: (2Z)- 7- {[bis(2- methoxyethyl)ammonio]methyl}- 2- (4- bromobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: COCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccc(cc1)Br)/C2=O)CCOC

STK582379
Synonyms: 8- (4- ethoxyphenyl)- 9- (5- methyl- 1,2- oxazol- 3- yl)- 8,9- dihydrobenzo[7,8]chromeno[2,3- c]pyrrole- 7,10- dione
Smiles: CCOc1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c2ccccc2cc1

STK582380
Synonyms: 3- methylbutyl[(2,6- dichlorophenyl)(hydroxy)methyl][4- (dimethylamino)phenyl]phosphinate
Smiles: CC(CCOP(=O)(C(c1c(Cl)cccc1Cl)O)c1ccc(cc1)N(C)C)C

STK582381
Synonyms: (2- {[(2'S,3S,3'S,10b'R)- 2'- (furan- 2- ylcarbonyl)- 2- oxo- 1,2,2',3'- tetrahydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 3'- yl]carbonyl}phenoxy)acetonitrile
Smiles: N#CCOc1ccccc1C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccco1)C(=O)Nc1c2cccc1)cccc3

STK582382
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- (3- ethoxyphenyl)- 1- {5- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}pyrrolidine- 2,3- dione
Smiles: CCOc1cccc(c1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK582385
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- chlorophenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- ethylphenyl)acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)Cl

STK582387
Synonyms: 4- {(E)- hydroxy[2- (3- hydroxyphenyl)- 1- (2- methoxyethyl)- 4,5- dioxopyrrolidin- 3- ylidene]methyl}- N,N- dimethylbenzenesulfonamide
Smiles: COCCN1C(c2cccc(c2)O)/C(=C(/c2ccc(cc2)S(=O)(=O)N(C)C)\O)/C(=O)C1=O

STK582388
Synonyms: (2Z)- 2- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 7(8H)- ylidene)- 1- (thiophen- 2- yl)ethanone
Smiles: O=C(c1cccs1)/C=C/1\NCCc2c1cc1OCCCOc1c2

STK582389
Synonyms: 3- (4- chlorophenyl)- 7- (4- methylpiperazin- 1- yl)- 5- phenylpyrazolo[1,5- a]pyrimidine
Smiles: CN1CCN(CC1)c1cc(nc2n1ncc2c1ccc(cc1)Cl)c1ccccc1

STK582390
Synonyms: 6''- amino- 3''- propyl- 2''H- dispiro[1,3- dioxolane- 2,1'- cyclohexane- 4',4''- pyrano[2,3- c]pyrazole]- 5''- carbonitrile
Smiles: CCCc1[nH]nc2c1C1(CCC3(CC1)OCCO3)C(=C(O2)N)C#N

STK582391
Synonyms: 9- (4- methylphenyl)- 6- (3,4,5- trimethoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1c(OC)cc(cc1OC)C1CC(=C2C(=Nc3n(C2c2ccc(cc2)C)ncn3)C1)O

STK582392
Synonyms: (2S)- 2- (4- oxoquinazolin- 3(4H)- yl)- N- [4- (trifluoromethoxy)phenyl]propanamide
Smiles: O=C([C@@H](n1cnc2c(c1=O)cccc2)C)Nc1ccc(cc1)OC(F)(F)F

STK582393
Synonyms: 2- ethyl- 1- {(2E)- 2- [(2- hydroxy- 6- methylquinolin- 3- yl)methylidene]hydrazinyl}- 3- methylpyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(c1N/N=C/c1cc3cc(C)ccc3nc1O)c1ccccc1n2

STK582394
Synonyms: (4E)- 1- (5- bromopyridin- 2- yl)- 4- [(4- chlorophenyl)(hydroxy)methylidene]- 5- (4- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: Clc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)[N+](=O)[O-])N(C(=O)C1=O)c1ccc(cn1)Br)/O

STK582395
Synonyms: 8- butyl- 4- hydroxy- 1,7- dimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: CCCCn1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK582396
Synonyms: (3a'S,6a'R)- 5- fluoro- 3'- (1- hydroxyethyl)- 5'- (3- methoxypropyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(O)C)C(=O)Nc2c1cc(F)cc2

STK582397
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- [3- ethoxy- 4- (prop- 2- en- 1- yloxy)phenyl]- 1- {5- [(4- methylbenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}pyrrolidine- 2,3- dione
Smiles: C=CCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccc(cc2)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK582398
Synonyms: 2- {[4- amino- 5- (5- methyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [4- chloro- 2- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1C(F)(F)F)Cl)CSc1nnc(n1N)c1n[nH]c(c1)C

STK582400
Synonyms: 2- chloro- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (tetrahydrofuran- 2- ylmethyl)benzamide
Smiles: Cc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1ccccc1Cl)CC1CCCO1

STK582401
Synonyms: 2,3- dihydro- 1H- cyclopenta[b]quinolin- 9- yl[4- (2- fluorophenyl)piperazin- 1- yl]methanone
Smiles: Fc1ccccc1N1CCN(CC1)C(=O)c1c2CCCc2nc2c1cccc2

STK582404
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 2- ylmethyl)- N'- (2- methylphenyl)ethanediamide
Smiles: O=C(C(=O)NCC1COc2c(O1)cccc2)Nc1ccccc1C

STK582405
Synonyms: N- (3,4- dimethylphenyl)- 2- {[4- (4- methoxyphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(c(c2)C)C)nnc1c1ccccn1

STK582406
Synonyms: methyl[3- (furan- 2- ylmethyl)- 2,4- dioxo- 3,4,6,7,8,9- hexahydro- 2H- cyclohepta[4,5]thieno[2,3- d]pyrimidin- 1(5H)- yl]acetate
Smiles: COC(=O)Cn1c2sc3c(c2c(=O)n(c1=O)Cc1ccco1)CCCCC3

STK582409
Synonyms: (4E)- 1- [5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- [3- ethoxy- 4- (3- methylbutoxy)phenyl]pyrrolidine- 2,3- dione
Smiles: CCOc1cc(ccc1OCCC(C)C)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccccc1

STK582411
Synonyms: N- (2- fluorophenyl)- 2- {[4- (4- methylphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2F)nnc1c1ccccn1

STK582412
Synonyms: 1- (4- methylphenyl)- 6- propyl- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: CCCN1CNc2c(C1)c(=O)nc(n2c1ccc(cc1)C)S

STK582414
Synonyms: (5Z)- 5- {[(2,4- dimethoxyphenyl)amino]methylidene}- 3- (3,4- dimethylphenyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(c(c1)OC)N/C=C\1/C(=NC(=O)N(C1=O)c1ccc(c(c1)C)C)O

STK582416
Synonyms: 1'- [2- (3,4- dimethoxyphenyl)ethyl]- 2'- hydroxy- 3- methyl- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 4',6'(1'H)- dione
Smiles: COc1cc(CCN2C(=NC(=O)C3(C2=O)Cc2ccccc2N2C3CN(C)CC2)O)ccc1OC

STK582418
Synonyms: N- [4- (4- methoxyphenyl)- 6- methyl- 2- (4- methylphenyl)- 5- oxo- 2,5- dihydropyridazin- 3- yl]- 4- methylbenzamide
Smiles: COc1ccc(cc1)c1c(=O)c(C)nn(c1NC(=O)c1ccc(cc1)C)c1ccc(cc1)C

STK582419
Synonyms: 9- (2- fluorobenzyl)- 6- methyl- 2,3,9,10- tetrahydro- 8H- cyclopenta[3,4]chromeno[6,7- e][1,3]oxazin- 4(1H)- one
Smiles: Fc1ccccc1CN1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCC2

STK582420
Synonyms: N- (biphenyl- 2- yl)- 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2c2ccccc2)nnc1c1cccc(c1)Cl

STK582421
Synonyms: (2- benzylphenyl)(6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=O)c1ccccc1Cc1ccccc1

STK582422
Synonyms: N- (2,4- dimethylphenyl)- 2- {[4- phenyl- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nnc(n1c1ccccc1)c1nccnc1

STK582423
Synonyms: 9- (3,5- difluorophenyl)- 6- (4- methoxyphenyl)- 2- (trifluoromethyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2cc(F)cc(c2)F)nc(n3)C(F)(F)F)C1)O

STK582424
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (4- fluorophenyl)- 5- (3- hydroxypropyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCCN1C(=O)c2c(C1c1ccc(cc1)F)c([nH]n2)c1cc(Cl)c(cc1O)C

STK582425
Synonyms: N- (2,3- dimethoxybenzyl)- 4- methoxy- N- [3- (morpholin- 4- yl)propyl]benzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)N(Cc1cccc(c1OC)OC)CCCN1CCOCC1

STK582426
Synonyms: (4E)- 4- [hydroxy(5- methylfuran- 2- yl)methylidene]- 5- (3- methoxyphenyl)- 1- [5- (methylsulfanyl)- 1,3,4- thiadiazol- 2- yl]pyrrolidine- 2,3- dione
Smiles: COc1cccc(c1)C1/C(=C(/c2ccc(o2)C)\O)/C(=O)C(=O)N1c1nnc(s1)SC

STK582427
Synonyms: 4- {[(E)- (5- bromo- 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/c1cc(Br)ccc1F

STK582429
Synonyms: 3- (4- tert- butylphenyl)- 5- [(3- fluorobenzyl)sulfanyl]- 4- phenyl- 4H- 1,2,4- triazole
Smiles: Fc1cccc(c1)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C

STK582430
Synonyms: 4- chloro- N- [7- (4- fluorophenyl)- 5- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]- 3- nitrobenzamide
Smiles: Fc1ccc(cc1)C1C=C(N=c2n1nc([nH]2)NC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl)c1ccccc1

STK582431
Synonyms: 5- (3- chlorophenyl)- 4- {[(E)- (3,4- dimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(ccc1OC)/C=N/n1c(=S)[nH]nc1c1cccc(c1)Cl

STK582432
Synonyms: N- (2,6- dimethylphenyl)- 2- ({4- (4- ethoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cccc2C)nnc1COc1ccc(cc1)C

STK582433
Synonyms: 1- [1]benzofuro[3,2- d]pyrimidin- 4- ylproline
Smiles: OC(=O)C1CCCN1c1ncnc2c1oc1c2cccc1

STK582434
Synonyms: {4- [(3aR,4R,4aR,7aS,8R,8aR)- 6- tert- butyl- 5,7- dioxo- 4,4a,5,6,7,7a,8,8a- octahydro- 3aH- 4,8- methano[1,2]oxazolo[4,5- f]isoindol- 3- yl]- 2- methoxyphenoxy}acetonitrile
Smiles: N#CCOc1ccc(cc1OC)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(C)(C)C

STK582435
Synonyms: 6- hydroxy- 8- [(2- methoxyethyl)sulfanyl]- 3- methyl- 7- (3- methylbutyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: COCCSc1nc2c(n1CCC(C)C)c(O)nc(=O)n2C

STK582436
Synonyms: 2- [2- amino- 5- (3- methoxyphenoxy)- 6- methylpyrimidin- 4- yl]- 5- [(2- chlorobenzyl)oxy]phenol
Smiles: COc1cccc(c1)Oc1c(C)nc(nc1c1ccc(cc1O)OCc1ccccc1Cl)N

STK582438
Synonyms: 6- hydroxy- 7- [2- hydroxy- 3- (propan- 2- yloxy)propyl]- 8- [(3- hydroxypropyl)amino]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: OCCCNc1nc2c(n1CC(COC(C)C)O)c(O)nc(=O)n2C

STK582441
Synonyms: 4- [({[4- (4- chlorophenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK582442
Synonyms: (8S,8aR,11aS)- 10- (4- chlorophenyl)- 9,11- dioxo- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 8- carbonitrile
Smiles: N#C[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2C2N1C=Cc1c2cccc1)c1ccc(cc1)Cl

STK582443
Synonyms: N- (3- fluorophenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)F)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C

STK582445
Synonyms: 3'- benzyl- 6'- hydroxy- 1,2,3,4,5,5a- hexahydro- 2'H,7H,8H- spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[1,2- a]azepine- 6,5'- pyrimidine]- 2',4',8(3'H)- trione
Smiles: O=C1N=C(O)C2(C(=O)N1Cc1ccccc1)Cc1c(N3C2CCCCC3)nc2n(c1=O)cccc2

STK582446
Synonyms: 2- [(3a'S,6a'R)- 5'- (1,3- benzodioxol- 5- ylmethyl)- 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)Cc1ccc3c(c1)OCO3)C(=O)Nc1c2cc(F)cc1

STK582447
Synonyms: N- (2- benzyl- 5- hydroxy[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl)- 2- phenoxypropanamide
Smiles: Oc1cc(NC(=O)C(Oc2ccccc2)C)n2c(n1)nc(n2)Cc1ccccc1

STK582448
Synonyms: 2- [(4,8- dimethyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (pyridin- 4- ylmethyl)propanamide
Smiles: CC(C(=O)NCc1ccncc1)Oc1ccc2c(c1C)oc(=O)cc2C

STK582452
Synonyms: 4- (2,4- dichlorophenoxy)- 1- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)butan- 1- one
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)CCCOc1ccc(cc1Cl)Cl

STK582453
Synonyms: N- (4- bromo- 2- fluorophenyl)- 4- (4- oxoquinazolin- 3(4H)- yl)butanamide
Smiles: O=C(Nc1ccc(cc1F)Br)CCCn1cnc2c(c1=O)cccc2

STK582454
Synonyms: 10,10- dimethyl- 2- (3- nitrophenyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: [O-][N+](=O)c1cccc(c1)c1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

STK582455
Synonyms: (5E)- 6- hydroxy- 5- {[1- (4- methoxyphenyl)- 1H- pyrrol- 2- yl]methylidene}- 3- phenylpyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1)n1cccc1/C=C/1\C(=NC(=O)N(C1=O)c1ccccc1)O

STK582457
Synonyms: ethyl{[2- (3- methoxyphenyl)- 7,7- dimethyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)OC

STK582460
Synonyms: 7- methyl- 10- (pyridin- 3- ylmethyl)- 10,11- dihydro- 5H,9H- benzo[3,4]chromeno[6,7- e][1,3]oxazin- 5- one
Smiles: Cc1c2OCN(Cc2cc2c1oc(=O)c1c2cccc1)Cc1cccnc1

STK582462
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- methylphenyl)acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C)nnc1COc1ccccc1

STK582465
Synonyms: 1,1'- [(5- propyl- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinolin- 8- yl)imino]dipropan- 2- ol
Smiles: CCCc1nc2oc3c(c2c2c1CCCC2)ncnc3N(CC(O)C)CC(O)C

STK582466
Synonyms: (5E)- 5- (1- {[4- (dimethylamino)phenyl]amino}propylidene)- 6- hydroxy- 3- (2- methylphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O)/Nc1ccc(cc1)N(C)C

STK582467
Synonyms: 4- methyl- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (pyridin- 3- ylmethyl)benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N(Cc1cc2ccccc2[nH]c1=O)Cc1cccnc1

STK582468
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 2- {[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1Cl)NC(=O)CSc1nnc(n1C)c1cccc(c1)Cl

STK582469
Synonyms: (5E)- 5- {1- [(3- aminophenyl)amino]propylidene}- 6- hydroxy- 3- (prop- 2- en- 1- yl)pyrimidine- 2,4(3H,5H)- dione
Smiles: C=CCN1C(=O)N=C(/C(=C(\Nc2cccc(c2)N)/CC)/C1=O)O

STK582470
Synonyms: N'- [(E)- (3- hydroxyphenyl)methylidene]- 5- [4- (pentyloxy)phenyl]- 1H- pyrazole- 3- carbohydrazide
Smiles: CCCCCOc1ccc(cc1)c1[nH]nc(c1)C(=O)N/N=C/c1cccc(c1)O

STK582471
Synonyms: 5- butyl- 3- (4- fluorophenyl)- 3H- pyrrolo[2',3':4,5]pyrimido[1,6- a]benzimidazol- 1- ylpentanoate
Smiles: CCCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCCC)cccc3)c1ccc(cc1)F

STK582472
Synonyms: (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)[3- (trifluoromethyl)phenyl]methanone
Smiles: COc1cc2CCN(Cc2cc1OC)C(=O)c1cccc(c1)C(F)(F)F

STK582473
Synonyms: 1- [11- (furan- 2- yl)- 1- hydroxy- 3- methyl- 2,3,4,11- tetrahydro- 10H- dibenzo[b,e][1,4]diazepin- 10- yl]- 2- phenoxyethanone
Smiles: CC1CC(=C2C(=Nc3ccccc3N(C2c2ccco2)C(=O)COc2ccccc2)C1)O

STK582474
Synonyms: 9- tert- butyl- N- [2- (2- hydroxyethoxy)ethyl]- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: OCCOCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CCC(C2)C(C)(C)C

STK582475
Synonyms: 2- (4- methoxyphenyl)- 7,7- dimethyl- 4- {[2- (pyrrolidin- 1- yl)ethyl]sulfanyl}- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidine
Smiles: COc1ccc(cc1)c1nc(SCCN2CCCC2)c2c(n1)CC(OC2)(C)C

STK582476
Synonyms: 7- (4- acetylphenyl)- 3- (4- chlorophenyl)- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: Clc1ccc(cc1)C1=NOC2(C1)CC(=O)N(C2=O)c1ccc(cc1)C(=O)C

STK582478
Synonyms: (E)- {2- (2,3- dimethoxyphenyl)- 1- [3- (morpholin- 4- ium- 4- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}[3- fluoro- 4- (propan- 2- yloxy)phenyl]methanolate
Smiles: COc1c(OC)cccc1C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)F)OC(C)C)/[O-]

STK582480
Synonyms: 6- (3,4- dimethoxyphenyl)- 9- (4- fluorophenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1ccc(cc1OC)C1CC(=C2C(=Nc3n(C2c2ccc(cc2)F)ncn3)C1)O

STK582482
Synonyms: (2Z)- 2- [(3- methylthiophen- 2- yl)methylidene]- 7- (morpholin- 4- ium- 4- ylmethyl)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCOCC1)O/C(=C\c1sccc1C)/C2=O

STK582483
Synonyms: 4- methoxy- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (tetrahydrofuran- 2- ylmethyl)benzamide
Smiles: COc1ccc(cc1)C(=O)N(Cc1cc2cc(C)ccc2[nH]c1=O)CC1CCCO1

STK582484
Synonyms: 5- (4- chlorophenyl)- 10- (3,4- dihydroxyphenyl)- 1,3- dimethyl- 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(c3n1CCOC3c1ccc(c(c1)O)O)n(C)c(=O)n(c2=O)C

STK582487
Synonyms: 2- {[3- (4- chlorophenyl)- 4- oxo- 3,4,5,6,7,8- hexahydro[1]benzothieno[2,3- d]pyrimidin- 2- yl]sulfanyl}- N- (3- fluoro- 4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)F)C)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Cl)CCCC3

STK582488
Synonyms: 4- {[(E)- (5- bromo- 2- methoxyphenyl)methylidene]amino}- 5- (4- fluorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1/C=N/n1c(=S)[nH]nc1c1ccc(cc1)F)Br

STK582489
Synonyms: N- (4- fluorobenzyl)- Nalpha- {[1- (L- valyl)piperidin- 4- yl]carbonyl}- L- phenylalaninamide
Smiles: O=C([C@H](Cc1ccccc1)NC(=O)C1CCN(CC1)C(=O)[C@H](C(C)C)N)NCc1ccc(cc1)F

STK582490
Synonyms: 3- [(4- tert- butylbenzyl)sulfanyl]- 4- (4- ethoxyphenyl)- 5- (4- methoxyphenyl)- 4H- 1,2,4- triazole
Smiles: CCOc1ccc(cc1)n1c(SCc2ccc(cc2)C(C)(C)C)nnc1c1ccc(cc1)OC

STK582491
Synonyms: (5Z)- 3- (3- chlorophenyl)- 2- hydroxy- 5- {[1- (propan- 2- yl)- 1H- indol- 3- yl]methylidene}- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: Clc1cccc(c1)N1C(=N/C(=C\c2cn(c3c2cccc3)C(C)C)/C1=O)O

STK582492
Synonyms: 7- fluoro- 2- [5- (2- methylpropyl)- 1,3,4- thiadiazol- 2- yl]- 1- phenyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CC(Cc1nnc(s1)N1C(=O)c2c(C1c1ccccc1)c(=O)c1c(o2)ccc(c1)F)C

STK582493
Synonyms: (3a'S,6a'R)- 5'- tert- butyl- 3'- (3,4- dihydroxybenzyl)- 5- fluoro- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C(C)(C)C)Cc1ccc(c(c1)O)O)C(=O)N2

STK582494
Synonyms: 6- (1- hydroxy- 2- methylpropan- 2- yl)- 5- (4- methoxyphenyl)- 1,3- dimethyl- 1H- pyrrolo[3,4- d]pyrimidine- 2,4(3H,6H)- dione
Smiles: COc1ccc(cc1)c1c2c(=O)n(C)c(=O)n(c2cn1C(CO)(C)C)C

STK582495
Synonyms: N- (2- chlorophenyl)- 4- (4- fluorophenyl)- 1- (4- methoxyphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1Cl)cc3c1ccc(cc1)F

STK582497
Synonyms: 3- (3- 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)Cc1cccc(c1)Cl

STK582498
Synonyms: methyl(3- {(E)- [1- (2- fluorobenzyl)- 2- hydroxy- 5- oxo- 1,5- dihydro- 4H- imidazol- 4- ylidene]methyl}- 1H- indol- 1- yl)acetate
Smiles: COC(=O)Cn1cc(c2c1cccc2)/C=C\1/N=C(N(C1=O)Cc1ccccc1F)O

STK582502
Synonyms: methylN- [(E)- (1- benzyl- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene)methyl]tryptophanate
Smiles: COC(=O)C(Cc1c[nH]c2c1cccc2)N/C=C/1\C(=O)N=C(N(C1=O)Cc1ccccc1)S

STK582503
Synonyms: 2- phenyl- N- [2- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)ethyl]butanamide
Smiles: CCC(c1ccccc1)C(=O)NCCc1nnc2n1cccc2

STK582504
Synonyms: ethyl[(2Z)- 2- {[(4- bromophenyl)carbonyl]imino}- 2,3- dihydro- 1,3- thiazol- 4- yl]acetate
Smiles: CCOC(=O)Cc1cs/c(=N\C(=O)c2ccc(cc2)Br)/[nH]1

STK582508
Synonyms: N- [(2Z)- 3- (3- methoxyphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- (thiophen- 2- yl)acetamide
Smiles: COc1cccc(c1)N1/C(=N/C(=O)Cc2cccs2)/SC2C1CS(=O)(=O)C2

STK582510
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,6- dimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cccc1C)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK582511
Synonyms: 4- (benzylamino)- 2- (dimethylamino)pyridine- 3- carbonitrile
Smiles: N#Cc1c(ccnc1N(C)C)NCc1ccccc1

STK582512
Synonyms: 3- [4- (ethoxycarbonyl)phenoxy]- 8- {[4- (2- hydroxyethyl)piperazin- 1- ium- 1- yl]methyl}- 2- methyl- 4- oxo- 4H- chromen- 7- olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(C)c(c2=O)Oc1ccc(cc1)C(=O)OCC

STK582513
Synonyms: N- (2- bromo- 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(cc2Br)C)nnc1c1ccc(cc1)F

STK582514
Synonyms: 3- (4- fluorophenyl)- 10- methyl- 2- pentylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: CCCCCc1nc2c(c(=O)n1c1ccc(cc1)F)c(=O)c1c(n2C)cccc1

STK582517
Synonyms: 8- (3- chloro- 2- methylphenyl)- 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)c1cccc(c1C)Cl)C

STK582518
Synonyms: (5E)- 6- hydroxy- 3- (2- methylphenyl)- 5- (1- {[2- (piperidin- 1- yl)ethyl]amino}propylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O)/NCCN1CCCCC1

STK582522
Synonyms: 6- hydroxy- 3- methyl- 8- (morpholin- 4- ylmethyl)- 7- (2- phenylethyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: Oc1nc(=O)n(c2c1n(CCc1ccccc1)c(n2)CN1CCOCC1)C

STK582523
Synonyms: 7- methyl- 8- [(2,3,5,6- tetramethylphenyl)sulfonyl]- 3,4,7,8,9,10- hexahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline
Smiles: CC1c2cc3OCCCOc3cc2CCN1S(=O)(=O)c1c(C)c(C)cc(c1C)C

STK582524
Synonyms: 8- [(dibenzylamino)methyl]- 7- (3- hydroxypropyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCCCn1c(CN(Cc2ccccc2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK582525
Synonyms: (3a'S,6a'R)- 5'- (butan- 2- yl)- 5- fluoro- 3'- (propan- 2- yl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(C)C)C(=O)Nc2c1cc(F)cc2)C

STK582526
Synonyms: 2- (4- nitrophenyl)- 6,7,8,9- tetrahydro- 5H- cyclohepta[b]pyrazine1,4- dioxide
Smiles: [O-][N+](=O)c1ccc(cc1)c1c[n+]([O-])c2c([n+]1[O-])CCCCC2

STK582527
Synonyms: 9- (3- methoxyphenyl)- 6- (4- methoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2cccc(c2)OC)ncn3)C1)O

STK582528
Synonyms: 2- methyl- 7- (propylsulfanyl)- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidine
Smiles: CCCSc1nnc2n1c1sc3c(c1c1n2nc(n1)C)CCCC3

STK582531
Synonyms: 2- (3- methoxypropyl)- 1,3- dioxo- N- (2- phenylethyl)- 2,3- dihydro- 1H- isoindole- 5- carboxamide
Smiles: COCCCN1C(=O)c2c(C1=O)cc(cc2)C(=O)NCCc1ccccc1

STK582532
Synonyms: N- (4- fluorophenyl)- 6- (4- oxoquinazolin- 3(4H)- yl)hexanamide
Smiles: O=C(Nc1ccc(cc1)F)CCCCCn1cnc2c(c1=O)cccc2

STK582533
Synonyms: N- {4- [(2- methoxy- 5- {(E)- [1- (3- methylphenyl)- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}benzyl)oxy]phenyl}acetamide
Smiles: COc1ccc(cc1COc1ccc(cc1)NC(=O)C)/C=C/1\C(=O)N=C(N(C1=O)c1cccc(c1)C)S

STK582535
Synonyms: N- [(2S)- 1- (cyclohexylamino)- 4- (methylsulfanyl)- 1- oxobutan- 2- yl]- 1- [(4- methylphenyl)sulfonyl]piperidine- 4- carboxamide
Smiles: CSCC[C@@H](C(=O)NC1CCCCC1)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C

STK582536
Synonyms: 2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8(9H)- one
Smiles: Cc1nc2oc3c(c2c2c1COC(C2)(C)C)nc[nH]c3=O

STK582538
Synonyms: N- {[6- chloro- 8- (trifluoromethyl)[1,2,4]triazolo[4,3- a]pyridin- 3- yl]methyl}- 3,4- diethoxybenzamide
Smiles: CCOc1cc(ccc1OCC)C(=O)NCc1nnc2n1cc(Cl)cc2C(F)(F)F

STK582539
Synonyms: 4- {(2E)- 2- [(2- chloro- 8- methylquinolin- 3- yl)methylidene]hydrazinyl}benzoicacid
Smiles: Clc1nc2c(C)cccc2cc1/C=N/Nc1ccc(cc1)C(=O)O

STK582540
Synonyms: 1- (4- fluorophenyl)- 4- (4- hydroxyphenyl)- 4,7- dihydrofuro[3,4- b]pyridine- 2,5(1H,3H)- dione
Smiles: Oc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)OC2)c1ccc(cc1)F

STK582541
Synonyms: 2- ({5- [(1S)- 1- amino- 3- methylbutyl]- 1,3,4- oxadiazol- 2- yl}sulfanyl)- N,N- diethylacetamide
Smiles: CCN(C(=O)CSc1nnc(o1)[C@H](CC(C)C)N)CC

STK582542
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)OC

STK582543
Synonyms: N- (butan- 2- yl)- 6,6- dimethyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- amine
Smiles: CCC(Nc1nc(SC)nc2c1c1CC(C)(C)OCc1s2)C

STK582544
Synonyms: 2- amino- 4- {4- [(2- chlorobenzyl)oxy]- 3- methoxyphenyl}- 6- [3- (diethylamino)propyl]- 7- methyl- 5- oxo- 5,6- dihydro- 4H- pyrano[3,2- c]pyridine- 3- carbonitrile
Smiles: CCN(CCCn1c(C)cc2c(c1=O)C(c1ccc(c(c1)OC)OCc1ccccc1Cl)C(=C(O2)N)C#N)CC

STK582545
Synonyms: N- (4- butylphenyl)- 2- {[4- (4- ethoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OCC)c1cccc(c1)C

STK582546
Synonyms: (3a'R,8b'S)- 7- chloro- 2'- [2- (3,4- dimethoxyphenyl)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: COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(N4C3CCC4)C(=O)Nc3c2cccc3Cl)ccc1OC

STK582551
Synonyms: 7'- [(E)- (1- hexyl- 2- hydroxy- 4,6- dioxo- 1,6- dihydropyrimidin- 5(4H)- 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: CCCCCCN1C(=NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK582552
Synonyms: 2- {ethyl[4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl]amino}ethanol
Smiles: OCCN(c1ncnc2c1sc1c2c2CCCc2c(n1)CC(C)C)CC

STK582553
Synonyms: N- (4- bromo- 2- methylphenyl)- 2- {[4- (4- chlorophenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)Br)CSc1nnc(n1c1ccc(cc1)Cl)Cc1cccs1

STK582554
Synonyms: 2- (furan- 2- yl)- 5,9- dimethyl- 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)c1ccco1

STK582555
Synonyms: (1,3- benzothiazol- 2- ylsulfonyl)aceticacid
Smiles: OC(=O)CS(=O)(=O)c1nc2c(s1)cccc2

STK582556
Synonyms: 3- (3- fluorophenyl)- 3,4,7,8,9,10- hexahydro- 2H,6H- benzo[3,4]chromeno[8,7- e][1,3]oxazin- 6- one
Smiles: Fc1cccc(c1)N1COc2c(C1)c1oc(=O)c3c(c1cc2)CCCC3

STK582559
Synonyms: 2- (4- methoxyphenyl)- 7,7- dimethyl- 4- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidine
Smiles: COc1ccc(cc1)c1nc(SCC(=C)C)c2c(n1)CC(OC2)(C)C

STK582560
Synonyms: 2- (1,3- benzothiazol- 2- yl)- 1- (3- ethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1cccc(c1)C1N(c2nc3c(s2)cccc3)C(=O)c2c1c(=O)c1c(o2)cccc1

STK582561
Synonyms: 2,2,2- trichloro- N- [3- (1H- tetrazol- 1- yl)phenyl]acetamide
Smiles: O=C(C(Cl)(Cl)Cl)Nc1cccc(c1)n1cnnn1

STK582562
Synonyms: 1- [(4- chlorophenyl)sulfonyl]- 3- [2- (cyclohex- 1- en- 1- yl)ethyl]- 2,3- dihydro- 1H- imidazo[4,5- b]quinoxaline
Smiles: Clc1ccc(cc1)S(=O)(=O)N1CN(c2c1nc1ccccc1n2)CCC1=CCCCC1

STK582564
Synonyms: 2- hydroxy- 1- phenyl- 6- propyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: CCCN1CNc2c(C1)c(=O)nc(n2c1ccccc1)O

STK582565
Synonyms: ethyl4- [({[3- cyano- 4- (furan- 2- yl)- 5- hydroxy- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1ccco1

STK582566
Synonyms: N'- [(E)- (2- chloro- 7- methylquinolin- 3- yl)methylidene]- 4- methylbenzenesulfonohydrazide
Smiles: Cc1ccc(cc1)S(=O)(=O)N/N=C/c1cc2ccc(cc2nc1Cl)C

STK582568
Synonyms: 4- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]- N- (2- methylpropyl)benzamide
Smiles: CC(CNC(=O)c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)C

STK582570
Synonyms: (5Z)- 5- [5- (4- ethoxyphenyl)- 1- phenylpyrazolidin- 3- ylidene]- 6- hydroxy- 3- (prop- 2- en- 1- yl)pyrimidine- 2,4(3H,5H)- dione
Smiles: C=CCN1C(=O)N=C(/C(=C/2\CC(N(N2)c2ccccc2)c2ccc(cc2)OCC)/C1=O)O

STK582571
Synonyms: N- (2,4- difluorophenyl)- 2- {[4- (4- methoxyphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2F)F)nnc1Cc1cccs1

STK582574
Synonyms: (6- fluoro- 2- methylquinolin- 4- yl)(4- methylpiperidin- 1- yl)methanone
Smiles: CC1CCN(CC1)C(=O)c1cc(C)nc2c1cc(F)cc2

STK582575
Synonyms: N'- {(1E)- 1- [4- hydroxy- 1- (4- methoxyphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]propyl}benzohydrazide
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)OC)O)/NNC(=O)c1ccccc1

STK582576
Synonyms: 8- (4- fluorophenyl)- 4- hydroxy- 1,6,7- trimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Fc1ccc(cc1)n1c(C)c(n2c1nc1c2c(O)nc(=O)n1C)C

STK582577
Synonyms: 1- (furan- 2- ylmethyl)- 7- methyl- 2,3- dihydro- 1H- pyrrolo[2,3- b]quinoline
Smiles: Cc1ccc2c(c1)nc1c(c2)CCN1Cc1ccco1

STK582578
Synonyms: 1,3- dimethyl- 5- {[2- (morpholin- 4- yl)- 4- oxo- 4H- pyrido[1,2- a]pyrimidin- 3- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: O=C1N(C)C(=O)C(=Cc2c(nc3n(c2=O)cccc3)N2CCOCC2)C(=O)N1C

STK582579
Synonyms: N- [3- (2- oxopyrrolidin- 1- yl)propyl]- 2- [(4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- yl)oxy]acetamide
Smiles: O=C(COc1ccc2c(c1)oc(=O)c1c2CCC1)NCCCN1CCCC1=O

STK582580
Synonyms: 3- [(4- tert- butylbenzyl)sulfanyl]- 4- (4- methoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazole
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2)C(C)(C)C)nnc1c1cccc(c1)C

STK582582
Synonyms: 1- (3- ethoxyphenyl)- 2- (6- fluoro- 1,3- benzothiazol- 2- yl)- 7- methyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1cccc(c1)C1N(c2sc3c(n2)ccc(c3)F)C(=O)c2c1c(=O)c1c(o2)ccc(c1)C

STK582583
Synonyms: 8- [3- (benzyloxy)phenyl]- 9- (5- methyl- 1,2- oxazol- 3- yl)- 8,9- dihydrobenzo[7,8]chromeno[2,3- c]pyrrole- 7,10- dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1cccc(c1)OCc1ccccc1)c(=O)c1c(o2)c2ccccc2cc1

STK582585
Synonyms: 3- (3,4,5- trimethoxyphenyl)- 3,4,8,9- tetrahydro- 2H- cyclopenta[3,4]chromeno[8,7- e][1,3]oxazin- 6(7H)- one
Smiles: COc1cc(cc(c1OC)OC)N1COc2c(C1)c1oc(=O)c3c(c1cc2)CCC3

STK582588
Synonyms: N- [(2E)- 1,3- benzothiazol- 2(3H)- ylidene]- 4,5- dimethoxy- 2- nitrobenzamide
Smiles: COc1cc(C(=O)/N=c\2/sc3c([nH]2)cccc3)c(cc1OC)[N+](=O)[O-]

STK582589
Synonyms: 7- methyl- 1,2- di(pyridin- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccn1)c1ccccn1

STK582591
Synonyms: (4E)- 5- [4- (benzyloxy)phenyl]- 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: Cc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccc(cc1)OCc1ccccc1

STK582592
Synonyms: 7- fluoro- 1- (4- fluorophenyl)- 2- methyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Fc1ccc(cc1)C1N(C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK582593
Synonyms: 3- (2- fluorophenyl)- 1',3'- dimethyl- 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: Fc1ccccc1N1CCN2C(C1)C1(Cc3c2cccc3)C(=O)N(C)C(=O)N(C1=O)C

STK582594
Synonyms: 1,7- dimethyl- 3- (2- methylpropyl)- 8- phenyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: CC(Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)c1ccccc1)C)C

STK582595
Synonyms: 4- oxo- N- {3- [(tetrahydrofuran- 2- ylmethyl)carbamoyl]- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl}- 4H- chromene- 2- carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cccc2)Nc1sc2c(c1C(=O)NCC1CCCO1)CCC2

STK582596
Synonyms: methylN- [(5- chloro- 2- methylphenyl)carbamoyl]- L- valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)Nc1cc(Cl)ccc1C

STK582597
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N- (4- chloro- 2- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1C)Cl)CSc1nnc(s1)SCc1ccccc1

STK582598
Synonyms: 2- ({5- [(4- methylphenoxy)methyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: NC(=O)CSc1nnc(n1c1ccc(cc1)C)COc1ccc(cc1)C

STK582602
Synonyms: 2- (6- methyl- 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(=O)c2c1c(=O)c1c(o2)cccc1

STK582604
Synonyms: 8- (3- chlorophenyl)- 9- [(3- hydroxypropyl)amino]- 4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7(8H)- one
Smiles: OCCCNc1nc2c3c(sc2c(=O)n1c1cccc(c1)Cl)nc(c1c3CCC1)CC(C)C

STK582605
Synonyms: 4- [({[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK582606
Synonyms: 5- [(2E)- 3- (1,3- benzodioxol- 5- yl)prop- 2- enoyl]- 3- butyl- 2,6- dihydroxypyrimidin- 4(3H)- one
Smiles: CCCCn1c(O)nc(c(c1=O)C(=O)/C=C/c1ccc2c(c1)OCO2)O

STK582607
Synonyms: 3- (4- bromophenyl)- 5- (2- ethyl- 2,3,4,9- tetrahydro- 1H- beta- carbolin- 1- yl)- 2,6- dihydroxypyrimidin- 4(3H)- one
Smiles: CCN1CCc2c(C1c1c(O)nc(n(c1=O)c1ccc(cc1)Br)O)[nH]c1c2cccc1

STK582608
Synonyms: 2- {[5- (2- fluorophenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- methylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C)nnc1c1ccccc1F

STK582609
Synonyms: N- (3,5- dimethoxyphenyl)- 2- {[4- (4- ethoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cc(OC)cc(c2)OC)nnc1COc1ccccc1

STK582611
Synonyms: 2- [(3- benzyl- 4,7- dimethyl- 2- oxo- 2H- chromen- 5- yl)oxy]- N- (pyridin- 3- ylmethyl)propanamide
Smiles: Cc1cc(OC(C(=O)NCc2cccnc2)C)c2c(c1)oc(=O)c(c2C)Cc1ccccc1

STK582612
Synonyms: 12- (3,4- dimethoxyphenyl)- 2- (pyridin- 4- 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)c1ccncc1

STK582613
Synonyms: 6'- amino- 5- methoxy- 3'- methyl- 2- oxo- 1'- phenyl- 1,2- dihydro- 1'H- spiro[indole- 3,4'- pyrano[2,3- c]pyrazole]- 5'- carbonitrile
Smiles: COc1ccc2c(c1)C1(C(=O)N2)C(=C(N)Oc2c1c(C)nn2c1ccccc1)C#N

STK582614
Synonyms: N- (4- bromo- 3- methylphenyl)- 2- {[4- (4- chlorophenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C)Br)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK582616
Synonyms: 2- [(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#Cc1ccccc1Cn1cc(c2c1cccc2)/C=C/1\C(=NC(=O)N(C1=O)Cc1ccco1)O

STK582617
Synonyms: N- (2- ethoxyphenyl)- 2- {[4- phenyl- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccccc1NC(=O)CSc1nnc(n1c1ccccc1)c1cnccn1

STK582618
Synonyms: N- [3- (4- chlorophenyl)- 4- oxo- 4H- chromen- 2- yl]- 4- fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1oc2ccccc2c(=O)c1c1ccc(cc1)Cl

STK582620
Synonyms: 6'- hydroxy- 3- methyl- 8- nitro- 3'- (2- phenylethyl)- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4'(3'H)- dione
Smiles: CN1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=NC(=O)N(C1=O)CCc1ccccc1)O

STK582621
Synonyms: 1- {2- [2,2- dimethyl- 4- (2- methylphenyl)tetrahydro- 2H- pyran- 4- yl]ethyl}piperidine
Smiles: Cc1ccccc1C1(CCOC(C1)(C)C)CCN1CCCCC1

STK582622
Synonyms: N- [2- (diethylamino)ethyl]- 10- methyl- 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(nc2)sc2c1CC(C)CC2)CC

STK582623
Synonyms: 4- (4- chloro- 2,5- dimethoxyphenyl)- 5- (pyridin- 3- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(Cl)c(cc1n1c(=S)[nH]nc1c1cccnc1)OC

STK582625
Synonyms: 7- chloro- 1- (4- ethoxyphenyl)- 2- (pyridin- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1ccc(cc1)C1N(c2ccccn2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK582626
Synonyms: 1- ethyl- 3- nitro- 4- (prop- 2- en- 1- ylamino)quinolin- 2(1H)- one
Smiles: C=CCNc1c([N+](=O)[O-])c(=O)n(c2c1cccc2)CC

STK582627
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (4- propoxyphenyl)- N'- [(E)- thiophen- 3- ylmethylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cscc1

STK582628
Synonyms: 4- nitro- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (pyridin- 3- ylmethyl)benzenesulfonamide
Smiles: O=c1[nH]c2ccccc2cc1CN(S(=O)(=O)c1ccc(cc1)[N+](=O)[O-])Cc1cccnc1

STK582629
Synonyms: 2- {[4- (4- methoxyphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [2- (propan- 2- yl)phenyl]acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(C)C)nnc1c1ccccn1

STK582632
Synonyms: N- [2- (2- fluorophenyl)ethyl]- 8- methoxy- 5H- pyrimido[5,4- b]indol- 4- amine
Smiles: COc1ccc2c(c1)c1ncnc(c1[nH]2)NCCc1ccccc1F

STK582633
Synonyms: N- [(2E)- 4,7- dimethylquinazolin- 2(1H)- ylidene]- 5- (tetrahydrofuran- 2- ylmethyl)- 1,4,5,6- tetrahydro- 1,3,5- triazin- 2- amine
Smiles: Cc1ccc2c(c1)[nH]/c(=N\C1=NCN(CN1)CC1CCCO1)/nc2C

STK582634
Synonyms: (1S,2S)- 2- phenyl- N'- [(E)- quinoxalin- 2- ylmethylidene]cyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1cnc2c(n1)cccc2

STK582636
Synonyms: 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]- N- (4- methylphenyl)hexanamide
Smiles: O=C(Nc1ccc(cc1)C)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK582637
Synonyms: (2Z)- 1- (4- bromophenyl)- 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 1(2H)- ylidene)ethanone
Smiles: COc1cc2/C(=C/C(=O)c3ccc(cc3)Br)/NCCc2cc1OC

STK582638
Synonyms: N- (3- chlorophenyl)- 2- {[5- (3- chlorophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)Cl)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK582639
Synonyms: N- (2- chloro- 4,6- dimethylphenyl)- 2- {[5- (2- fluorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1c(C)cc(cc1Cl)C)CSc1nnc(n1Cc1ccco1)c1ccccc1F

STK582641
Synonyms: (2'S,3R,7a'S)- N- (2,5- dimethoxyphenyl)- 5,7- dimethyl- 2- oxo- 1,1',2,2',5',6',7',7a'- octahydrospiro[indole- 3,3'- pyrrolizine]- 2'- carboxamide
Smiles: COc1ccc(c(c1)NC(=O)[C@H]1C[C@H]2N([C@@]31C(=O)Nc1c3cc(C)cc1C)CCC2)OC

STK582642
Synonyms: 7- methyl- 3- {(Z)- [3- (3- methylbutyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 2- (4- phenylpiperazin- 1- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CC(CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2)/C1=O)C

STK582643
Synonyms: 2- (2- oxo- 1,3- benzothiazol- 3(2H)- yl)- N- [(2Z)- 5- [(2- oxo- 2- phenylethyl)sulfanyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: O=C(Cn1c(=O)sc2c1cccc2)/N=c\1/[nH]nc(s1)SCC(=O)c1ccccc1

STK582645
Synonyms: 1'- tert- butyl- 3- (2,5- dimethyl- 1H- pyrrol- 1- yl)- 6a,7,8,9,10,11- hexahydro- 2'H,5H- spiro[azepino[1,2- a]quinoline- 6,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: O=C1NC(=O)C2(C(=O)N1C(C)(C)C)Cc1cc(ccc1N1C2CCCCC1)n1c(C)ccc1C

STK582646
Synonyms: 1- {[1,3- dimethyl- 2,6- dioxo- 7- (2- phenylethyl)- 2,3,6,7- tetrahydro- 1H- purin- 8- yl]methyl}piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)Cc1nc2c(n1CCc1ccccc1)c(=O)n(c(=O)n2C)C

STK582647
Synonyms: N- (2,4- dimethylphenyl)- 5- methyl- 7- (thiophen- 3- yl)- 4,7- dihydrotetrazolo[1,5- a]pyrimidine- 6- carboxamide
Smiles: Cc1ccc(c(c1)C)NC(=O)C1=C(C)Nc2n(C1c1cscc1)nnn2

STK582648
Synonyms: 1- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 5- oxo- N- {(2S)- 1- oxo- 1- [(2- phenylethyl)amino]propan- 2- yl}pyrrolidine- 3- carboxamide
Smiles: O=C([C@@H](NC(=O)C1CC(=O)N(C1)c1ccc2c(c1)OCCO2)C)NCCc1ccccc1

STK582649
Synonyms: 4- {3- [(E)- (2- hydroxy- 5- oxo- 1- phenyl- 1,5- dihydro- 4H- imidazol- 4- ylidene)methyl]- 2,5- dimethyl- 1H- pyrrol- 1- yl}benzenesulfonamide
Smiles: O=C1/C(=C\c2cc(n(c2C)c2ccc(cc2)S(=O)(=O)N)C)/N=C(N1c1ccccc1)O

STK582651
Synonyms: N,1- dibenzyl- N- butyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: CCCCN(C(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1)Cc1ccccc1

STK582656
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(3- methoxyphenyl)carbonyl]- 2'- [(4- nitrophenyl)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)[N+](=O)[O-])C(=O)Nc1c2cccc1)cccc3

STK582657
Synonyms: (4E)- 1- hexyl- 4- [hydroxy(4- methylphenyl)methylidene]- 5- (4- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: CCCCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccc(cc1)[N+](=O)[O-]

STK582658
Synonyms: (4E)- 4- {[(2,4- dimethoxyphenyl)amino]methylidene}- 2- (4- methylphenyl)isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc(c(c1)OC)N/C=C\1/C(=O)N(c2ccc(cc2)C)C(=O)c2c1cccc2

STK582659
Synonyms: 3- [(Z)- (3- butyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 2- (4- phenylpiperazin- 1- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2ccccc2)/C1=O

STK582660
Synonyms: ethyl2- amino- 1- (4- chloro- 2- fluorophenyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxylate
Smiles: CCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1F)Cl

STK582661
Synonyms: 6- amino- N'- [(E)- quinolin- 8- ylmethylidene]hexanehydrazide
Smiles: NCCCCCC(=O)N/N=C/c1cccc2c1nccc2

STK582662
Synonyms: methylN- [(2- chlorophenyl)carbamoyl]- D- methioninate
Smiles: CSCC[C@H](C(=O)OC)NC(=O)Nc1ccccc1Cl

STK582663
Synonyms: (4E)- 4- {[(1,1- dioxidotetrahydrothiophen- 3- yl)amino]methylidene}- 2- phenylisoquinoline- 1,3(2H,4H)- dione
Smiles: O=C1N(c2ccccc2)C(=O)c2c(/C/1=C\NC1CCS(=O)(=O)C1)cccc2

STK582664
Synonyms: 1- (4- ethoxyphenyl)- N- (4- methoxyphenyl)- 4- (4- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCOc1ccc(cc1)c1c(C(=O)Nc2ccc(cc2)OC)n2c3c1CCCCn3c(c2)c1ccc(cc1)C

STK582665
Synonyms: N- [(2E)- 3- (4- chlorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]cyclohexanecarboxamide
Smiles: Clc1ccc(cc1)N1/C(=N\C(=O)C2CCCCC2)/SC2C1CS(=O)(=O)C2

STK582667
Synonyms: N- (2- hydroxyethyl)- 5- methyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: OCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCC2

STK582669
Synonyms: 5- [(2E)- 3- (4- chlorophenyl)prop- 2- enoyl]- 2,6- dihydroxy- 3- (2- phenylethyl)pyrimidin- 4(3H)- one
Smiles: Clc1ccc(cc1)/C=C/C(=O)c1c(O)nc(n(c1=O)CCc1ccccc1)O

STK582671
Synonyms: 8- (3- methoxyphenyl)- 1,7- dimethyl- 3- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COc1cccc(c1)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK582673
Synonyms: N- (2- tert- butylphenyl)- 2- {[5- (3- methoxyphenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(C)(C)C)nnc1c1cccc(c1)OC

STK582674
Synonyms: N- (furan- 2- ylmethyl)- 4- methoxy- N- (4- methoxybenzyl)benzenesulfonamide
Smiles: COc1ccc(cc1)CN(S(=O)(=O)c1ccc(cc1)OC)Cc1ccco1

STK582675
Synonyms: 4- [(2E)- 2- (3- hydroxybenzylidene)hydrazinyl]benzoicacid
Smiles: Oc1cccc(c1)/C=N/Nc1ccc(cc1)C(=O)O

STK582676
Synonyms: {4- [(3aR,4R,4aR,7aS,8R,8aR)- 6- tert- butyl- 5,7- dioxo- 4,4a,5,6,7,7a,8,8a- octahydro- 3aH- 4,8- methano[1,2]oxazolo[4,5- f]isoindol- 3- yl]phenoxy}acetonitrile
Smiles: N#CCOc1ccc(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(C)(C)C

STK582680
Synonyms: ethyl1- (8- chloro[1]benzofuro[3,2- d]pyrimidin- 4- yl)piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)c1ncnc2c1oc1c2cc(cc1)Cl

STK582682
Synonyms: 1'- butyl- 6- hydroxy- 6'- nitro- 3- (propan- 2- yl)- 2'- propyl- 1',4'- dihydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinoline]- 2,4(3H)- dione
Smiles: CCCCN1c2ccc(cc2CC2(C1CCC)C(=NC(=O)N(C2=O)C(C)C)O)[N+](=O)[O-]

STK582683
Synonyms: 8- [(4- benzylpiperazin- 1- yl)methyl]- 1,3- dimethyl- 7- (2- oxo- 2- phenylethyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: O=C(c1ccccc1)Cn1c(CN2CCN(CC2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK582684
Synonyms: 9'- fluoro- 1- methyl- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- trione
Smiles: O=C1NC(=O)C2(C(=O)N1C)Cc1cccc(c1N1C2CCC1)F

STK582685
Synonyms: (3a'S,6a'R)- 5- bromo- 5'- (butan- 2- yl)- 3'- (2- methylpropyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(C)C)C(=O)Nc2c1cc(Br)cc2)C

STK582686
Synonyms: N- (2- {2- [(E)- {1- [2- (3,4- dimethoxyphenyl)ethyl]- 2,4,6- trioxotetrahydropyrimidin- 5(2H)- ylidene}methyl]- 1H- indol- 3- yl}ethyl)- N- ethylacetamide
Smiles: CCN(C(=O)C)CCc1c(/C=C/2\C(=O)NC(=O)N(C2=O)CCc2ccc(c(c2)OC)OC)[nH]c2c1cccc2

STK582690
Synonyms: 4- ({(E)- [4- (dimethylamino)phenyl]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/c1ccc(cc1)N(C)C)C

STK582691
Synonyms: (E)- {1- [2- (dimethylammonio)ethyl]- 2- (4- ethoxy- 3- methoxyphenyl)- 4,5- dioxopyrrolidin- 3- ylidene}[4- (2- methylpropoxy)phenyl]methanolate
Smiles: CCOc1ccc(cc1OC)C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCC(C)C)/[O-]

STK582692
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (phenoxymethyl)- 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)COc1ccccc1

STK582694
Synonyms: 7- (4- methylpiperazin- 1- yl)- 4- (propan- 2- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: CN1CCN(CC1)c1ncnc2c1oc1c2c2CCCc2c(n1)C(C)C

STK582696
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,5- dichlorophenyl)acetamide
Smiles: O=C(Nc1cc(Cl)ccc1Cl)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK582698
Synonyms: N- [4- (4- chlorophenyl)- 6- methyl- 5- oxo- 2- phenyl- 2,5- dihydropyridazin- 3- yl]- 4- methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)Nc1n(nc(c(=O)c1c1ccc(cc1)Cl)C)c1ccccc1

STK582699
Synonyms: 3- (4- chlorophenyl)- 7- methyl- 1- [2- (piperidin- 1- yl)ethyl]- 5,6,7,8- tetrahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidine- 2,4(1H,3H)- dione
Smiles: CN1CCc2c(C1)sc1c2c(=O)n(c(=O)n1CCN1CCCCC1)c1ccc(cc1)Cl

STK582701
Synonyms: 1- [2- (2- methoxyphenyl)- 8- methyl- 10- phenyl- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- yl]ethanone
Smiles: COc1ccccc1c1nn2c(n1)c1c(nc2)OC(=C(C1c1ccccc1)C(=O)C)C

STK582706
Synonyms: (2'S,3R,7a'S)- N- (2,5- dimethoxyphenyl)- 5- fluoro- 2- oxo- 1,1',2,2',5',6',7',7a'- octahydrospiro[indole- 3,3'- pyrrolizine]- 2'- carboxamide
Smiles: COc1ccc(cc1NC(=O)[C@H]1C[C@H]2N([C@@]31C(=O)Nc1c3cc(F)cc1)CCC2)OC

STK582708
Synonyms: 4- [(3aR,6aS)- 3- (2,3- dimethoxyphenyl)- 4,6- dioxo- 3a,4,6,6a- tetrahydro- 5H- pyrrolo[3,4- d][1,2]oxazol- 5- yl]phenylacetate
Smiles: COc1c(OC)cccc1C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)OC(=O)C

STK582709
Synonyms: (5Z)- 5- {[1- (3- hydroxyphenyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]methylidene}- 3- methyl- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: Oc1cccc(c1)n1c(C)cc(c1C)/C=C/1\SC(=S)N(C1=O)C

STK582713
Synonyms: 2- (trifluoromethyl)- 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)CCCC2=Nc2n1nc(n2)C(F)(F)F

STK582714
Synonyms: N- butyl- 4- tert- butyl- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: CCCCN(C(=O)c1ccc(cc1)C(C)(C)C)Cc1cc2ccc(cc2[nH]c1=O)C

STK582715
Synonyms: 5- bromo- N- (pyridin- 3- ylmethyl)- 1H- indole- 2- carboxamide
Smiles: Brc1ccc2c(c1)cc([nH]2)C(=O)NCc1cccnc1

STK582719
Synonyms: N- [5- hydroxy- 2- (phenoxymethyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]- 2- methoxybenzamide
Smiles: COc1ccccc1C(=O)Nc1cc(O)nc2n1nc(n2)COc1ccccc1

STK582721
Synonyms: 5- (2- hydroxy- 4,5- dimethylphenyl)- N- [5- (methylsulfanyl)- 1,3,4- thiadiazol- 2- yl]- 1H- pyrazole- 3- carboxamide
Smiles: CSc1nnc(s1)NC(=O)c1n[nH]c(c1)c1cc(C)c(cc1O)C

STK582722
Synonyms: N- (4- bromophenyl)- 2- {[4- (4- chlorophenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK582723
Synonyms: 5- {[3- (1H- imidazol- 1- yl)propyl]amino}- 2- (2- methoxyphenyl)- 1,3- oxazole- 4- carbonitrile
Smiles: N#Cc1nc(oc1NCCCn1cncc1)c1ccccc1OC

STK582725
Synonyms: 7- (4- fluorobenzyl)- 6- hydroxy- 8- {[3- (1H- imidazol- 1- yl)propyl]amino}- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Fc1ccc(cc1)Cn1c(NCCCn2cncc2)nc2c1c(O)nc(=O)n2C

STK582726
Synonyms: 5- (3,4- dimethoxyphenyl)- N'- [(E)- (3- methoxyphenyl)methylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: COc1cccc(c1)/C=N/NC(=O)c1n[nH]c(c1)c1ccc(c(c1)OC)OC

STK582728
Synonyms: (4E)- 4- [(4- bromophenyl)(hydroxy)methylidene]- 5- (4- fluorophenyl)pyrrolidine- 2,3- dione
Smiles: Fc1ccc(cc1)C1NC(=O)C(=O)/C/1=C(\c1ccc(cc1)Br)/O

STK582729
Synonyms: N- (3- bromophenyl)- 2- ({5- [(4- chlorophenoxy)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2)Br)nnc1COc1ccc(cc1)Cl

STK582730
Synonyms: 5- (2- methoxyphenyl)- 4- {[(E)- pyridin- 3- ylmethylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccccc1c1n[nH]c(=S)n1/N=C/c1cccnc1

STK582731
Synonyms: 2- {5- [(4- bromobenzyl)sulfanyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}pyrazine
Smiles: Cc1ccc(cc1)n1c(SCc2ccc(cc2)Br)nnc1c1nccnc1

STK582734
Synonyms: propyl[4- (dimethylamino)phenyl][(4- methylphenyl)(phenylamino)methyl]phosphinate
Smiles: CCCOP(=O)(C(c1ccc(cc1)C)Nc1ccccc1)c1ccc(cc1)N(C)C

STK582735
Synonyms: 5- (2- hydroxy- 3,4- dimethylphenyl)- N- [2- (phenylcarbonyl)- 1- benzofuran- 3- yl]- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)c1ccc(c(c1O)C)C)Nc1c(oc2c1cccc2)C(=O)c1ccccc1

STK582738
Synonyms: propan- 2- yl{[5- (3- methylphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetate
Smiles: CC(OC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C)C

STK582739
Synonyms: 7- chloro- 6- methyl- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- (3- propoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCCOc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK582740
Synonyms: 6- amino- 4- (2- methoxynaphthalen- 1- yl)- 3- methyl- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1c(OC)ccc3c1cccc3)c(C)[nH]n2

STK582741
Synonyms: 4- {[(E)- (3,5- dibromo- 2- hydroxyphenyl)methylidene]amino}- 5- (2,4- dichlorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccc(c(c1)Cl)c1n[nH]c(=S)n1/N=C/c1cc(Br)cc(c1O)Br

STK582743
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,6- dimethylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2c(C)cccc2C)nnc1COc1ccc(cc1)Cl

STK582744
Synonyms: N- [3- (2- chlorophenyl)- 1- ethyl- 4- oxo- 1,4- dihydroquinolin- 2- yl]- 3- nitrobenzamide
Smiles: CCn1c(NC(=O)c2cccc(c2)[N+](=O)[O-])c(c2ccccc2Cl)c(=O)c2c1cccc2

STK582746
Synonyms: 7- (3- chlorophenyl)- 3- (4- chlorophenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: Clc1ccc(cc1)c1nnc2n1cnc1c2cnn1c1cccc(c1)Cl

STK582747
Synonyms: N- {(2S)- 1- [(furan- 2- ylmethyl)amino]- 1- oxopropan- 2- yl}- 1- (4- methoxyphenyl)- 5- oxopyrrolidine- 3- carboxamide
Smiles: COc1ccc(cc1)N1CC(CC1=O)C(=O)N[C@H](C(=O)NCc1ccco1)C

STK582748
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- methylbutyl)acetamide
Smiles: CC(CCNC(=O)Cn1c2ccc(cc2c2c1c(=O)n1CCSc1n2)F)C

STK582749
Synonyms: 3- [3- (dibutylamino)propyl]- 8- ethoxy- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCCCN(CCCn1cnc2c(c1=O)[nH]c1c2cc(cc1)OCC)CCCC

STK582750
Synonyms: N- [4- (4- methoxyphenyl)- 1,2,5- oxadiazol- 3- yl]- 4- methylbenzamide
Smiles: COc1ccc(cc1)c1nonc1NC(=O)c1ccc(cc1)C

STK582751
Synonyms: 1- {N- [(2,3,5,9- tetramethyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)acetyl]glycyl}piperidine- 4- carboxylicacid
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C)NCC(=O)N1CCC(CC1)C(=O)O

STK582754
Synonyms: (2E)- 3- (4- chlorophenyl)- 1- (6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)prop- 2- en- 1- one
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=O)/C=C/c1ccc(cc1)Cl

STK582755
Synonyms: 1- hydroxy- 9- oxo- 9H- xanthen- 3- ylN- [(4- methylphenyl)sulfonyl]- D- phenylalaninate
Smiles: O=C([C@H](NS(=O)(=O)c1ccc(cc1)C)Cc1ccccc1)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1

STK582756
Synonyms: 3- [(3a'S,6a'R)- 7- chloro- 5'- (2- chlorobenzyl)- 2,4',6'- trioxo- 1,2,3',3a',4',5',6',6a'- octahydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 3'- yl]propanoicacid
Smiles: OC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2cccc1Cl

STK582758
Synonyms: N- (furan- 2- ylmethyl)- 4- methoxy- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: COc1ccc(cc1)C(=O)N(Cc1cc2cc(C)ccc2[nH]c1=O)Cc1ccco1

STK582759
Synonyms: N- (7- methoxy- 2,3- dihydro- 1H- pyrrolo[2,3- b]quinolin- 1- yl)benzamide
Smiles: COc1ccc2c(c1)nc1c(c2)CCN1NC(=O)c1ccccc1

STK582760
Synonyms: 4- (3,4- dichlorophenyl)- 1- (4- ethylphenyl)- N- phenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1)cc3c1ccc(c(c1)Cl)Cl

STK582761
Synonyms: 2- fluoro- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (2- methylpropyl)benzamide
Smiles: CC(CN(C(=O)c1ccccc1F)Cc1cc2ccc(cc2[nH]c1=O)C)C

STK582762
Synonyms: N- (3,5- dichlorophenyl)- 2- {[4- (4- methylphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)cc(c1)Cl)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK582764
Synonyms: 3- (2- fluorophenyl)- 1',3'- dimethyl- 8- nitro- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1cc(ccc1N1C2CN(CC1)c1ccccc1F)[N+](=O)[O-]

STK582765
Synonyms: 2- methyl- 1- {4- [4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl]piperazin- 1- yl}propan- 1- one
Smiles: CC(Cc1nc2sc3c(c2c2c1CCC2)ncnc3N1CCN(CC1)C(=O)C(C)C)C

STK582766
Synonyms: 9- (4- ethylphenyl)- 4- (2- oxo- 2H- chromen- 3- yl)- 9,10- dihydro- 2H,8H- chromeno[8,7- e][1,3]oxazin- 2- one
Smiles: CCc1ccc(cc1)N1COc2c(C1)c1oc(=O)cc(c1cc2)c1cc2ccccc2oc1=O

STK582767
Synonyms: 7- (4- ethylpiperazin- 1- yl)- 2- methyl- 3- phenyl- 5- (propan- 2- yl)pyrazolo[1,5- a]pyrimidine
Smiles: CCN1CCN(CC1)c1cc(nc2n1nc(c2c1ccccc1)C)C(C)C

STK582768
Synonyms: 2- {[4- amino- 5- (2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4- dichlorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nnc(n1N)c1[nH]nc2c1CCC2

STK582769
Synonyms: 9- (4- fluorophenyl)- 1,7- dimethyl- 3- (2- methylprop- 2- en- 1- yl)- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1ccc(cc1)F

STK582771
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(4- fluorophenyl)carbonyl]- 2'- (furan- 2- ylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Fc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccco1)C(=O)Nc1c2cccc1)cccc3

STK582772
Synonyms: (3S,3a'R,8a'S,8b'S)- 7- chloro- 2'- (2,6- dimethylphenyl)- 5- 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: Cc1cc(Cl)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1c(C)cccc1C

STK582773
Synonyms: 4- methyl- N- [(3Z)- 8- methyl- 1- propyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]benzenesulfonamide
Smiles: CCCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)C)/c2c1nc1c(c2)cccc1C

STK582774
Synonyms: 8- (azepan- 1- yl)- 6- hydroxy- 7- [2- (4- methoxyphenyl)ethyl]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: COc1ccc(cc1)CCn1c(nc2c1c(O)nc(=O)n2C)N1CCCCCC1

STK582775
Synonyms: (5E)- 3- cyclohexyl- 6- hydroxy- 5- {1- [(pyridin- 3- ylmethyl)amino]propylidene}pyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)C1CCCCC1)O)/NCc1cccnc1

STK582776
Synonyms: 1- tert- butyl4- (4- butyl- 6- chloro- 2- oxo- 2H- chromen- 7- yl)piperidine- 1,4- dicarboxylate
Smiles: CCCCc1cc(=O)oc2c1cc(Cl)c(c2)OC(=O)C1CCN(CC1)C(=O)OC(C)(C)C

STK582778
Synonyms: N- [(1Z)- 1- {1- cyano- 2- [(2,5- dimethylphenyl)amino]- 2- oxoethylidene}- 1H- isoindol- 3- yl]thiophene- 2- carboxamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1cccs1)/C(=O)Nc1cc(C)ccc1C

STK582780
Synonyms: (5Z)- 5- {[1- (4- chlorophenyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]methylidene}- 3- (2,5- dimethoxyphenyl)- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1N1C(=O)N=C(/C(=C/c2cc(n(c2C)c2ccc(cc2)Cl)C)/C1=O)O)OC

STK582782
Synonyms: 8- {[4- (2- hydroxyethyl)piperazin- 1- yl]methyl}- 7- (3- hydroxypropyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCCCn1c(CN2CCN(CC2)CCO)nc2c1c(=O)n(c(=O)n2C)C

STK582784
Synonyms: N- (furan- 2- ylmethyl)- 10- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CC1CCc2c(C1)c1c(s2)ncn2c1nc(n2)C(=O)NCc1ccco1

STK582787
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(2,4- dichlorophenyl)carbonyl]- 2'- [(4- methoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2Cl)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK582789
Synonyms: 4- {3- [(E)- (5- iminio- 2- methyl- 7- oxo- 5H- [1,3,4]thiadiazolo[3,2- a]pyrimidin- 6(7H)- ylidene)methyl]- 2,5- dimethyl- 1H- pyrrol- 1- yl}phenolate
Smiles: [O-]c1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=O)N=c2n(C1=[NH2+])nc(s2)C

STK582791
Synonyms: (4E)- 5- (2- fluorophenyl)- 1- hexyl- 4- [hydroxy(4- methylphenyl)methylidene]pyrrolidine- 2,3- dione
Smiles: CCCCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccccc1F

STK582793
Synonyms: 4- {[(E)- (2,4- dimethoxyphenyl)methylidene]amino}- 5- (4- ethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1OC)OC

STK582797
Synonyms: 8- methoxy- 3- (4- methoxybenzyl)- 2- (thiophen- 2- yl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COc1ccc(cc1)Cn1c(nc2c(c1=O)c(=O)c1c(o2)cc(cc1)OC)c1cccs1

STK582798
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 5- methoxy- 3- methyl- 1H- indole- 2- carboxamide
Smiles: COc1ccc2c(c1)c(C)c([nH]2)C(=O)Nc1ccc2c(c1)OCCO2

STK582799
Synonyms: methyl2- (3- {(E)- [1- (furan- 2- ylmethyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}- 2,5- dimethyl- 1H- pyrrol- 1- yl)- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)n1c(C)cc(c1C)/C=C/1\C(=NC(=O)N(C1=O)Cc1ccco1)O

STK582801
Synonyms: (1'R,2'R)- 2'- (2,5- dimethoxyphenyl)- 1'- (2,2- dimethylpropanoyl)- 7'- methyl- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: COc1ccc(c(c1)[C@H]1[C@@H](N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C)C(=O)C(C)(C)C)OC

STK582802
Synonyms: N- (4- ethylphenyl)- 2- hydroxy- 5- oxo- 7- phenyl- 3,4,5,6,7,8- hexahydroquinoline- 4- carboxamide
Smiles: CCc1ccc(cc1)NC(=O)C1CC(=NC2=C1C(=O)CC(C2)c1ccccc1)O

STK582804
Synonyms: methyl4- [8- hydroxy- 6- (4- methoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 9- yl]benzoate
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2ccc(cc2)C(=O)OC)ncn3)C1)O

STK582805
Synonyms: N- (2- bromo- 4- methylphenyl)- 2- {[4- (4- chlorophenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1Br)C)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK582806
Synonyms: 2- ({[(6- chloro- 3,4- dimethyl- 2- oxo- 2H- chromen- 7- yl)oxy]acetyl}amino)benzamide
Smiles: O=C(Nc1ccccc1C(=O)N)COc1cc2oc(=O)c(c(c2cc1Cl)C)C

STK582808
Synonyms: N- [(2E)- 6- fluoro- 1,3- benzothiazol- 2(3H)- ylidene]- 4- hydroxy- 1- octyl- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: CCCCCCCCn1c(=O)c(C(=O)/N=c\2/sc3c([nH]2)ccc(c3)F)c(c2c1cccc2)O

STK582809
Synonyms: N- benzyl- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzenesulfonamide
Smiles: O=c1[nH]c2ccccc2cc1CN(S(=O)(=O)c1ccccc1)Cc1ccccc1

STK582810
Synonyms: 2- ethyl- 3- (furan- 2- ylmethyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: CCc1nc2oc3ccccc3c(=O)c2c(=O)n1Cc1ccco1

STK582811
Synonyms: 8- cyclohexyl- 3- (5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl)- 2,3,3a,4,5,6- hexahydro- 1H- pyrazino[3,2,1- jk]carbazole
Smiles: C1CCC(CC1)c1ccc2c(c1)c1CCCC3c1n2CCN3c1ncnc2c1c1CCCCc1s2

STK582813
Synonyms: 8- {[4- (2- hydroxyethyl)piperazin- 1- ium- 1- yl]methyl}- 4- oxo- 3- [4- (propoxycarbonyl)phenoxy]- 2- (trifluoromethyl)- 4H- chromen- 7- olate
Smiles: CCCOC(=O)c1ccc(cc1)Oc1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+]1CCN(CC1)CCO)[O-]

STK582815
Synonyms: {(5S)- 3- [2- (cyanomethoxy)phenyl]- 5- [(4- fluorophenyl)carbamoyl]- 4,5- dihydro- 1,2- oxazol- 5- yl}aceticacid
Smiles: N#CCOc1ccccc1C1=NO[C@@](C1)(CC(=O)O)C(=O)Nc1ccc(cc1)F

STK582816
Synonyms: 4- hydroxy- 1,3- dimethyl- 5- [2- (prop- 2- en- 1- yloxy)phenyl]- 3,5- dihydro- 1H- indeno[2',1':5,6]pyrido[2,3- d]pyrimidine- 2,6- dione
Smiles: C=CCOc1ccccc1C1C2=C(N=c3c1c(O)n(C)c(=O)n3C)c1c(C2=O)cccc1

STK582817
Synonyms: 4- (3- benzyl- 4,8- dimethyl- 2- oxo- 2H- chromen- 7- yl)1- tert- butylpiperidine- 1,4- dicarboxylate
Smiles: O=C(C1CCN(CC1)C(=O)OC(C)(C)C)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1

STK582819
Synonyms: 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)- N- (1,2,3,4- tetrahydronaphthalen- 1- yl)acetamide
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)NC1CCCc2c1cccc2

STK582821
Synonyms: N- [7- (4- fluorophenyl)- 5- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]- 2- methoxybenzamide
Smiles: COc1ccccc1C(=O)Nc1nn2c(=NC(=CC2c2ccc(cc2)F)c2ccccc2)[nH]1

STK582822
Synonyms: N- (biphenyl- 2- yl)- 2- {[5- (2- methylphenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2c2ccccc2)nnc1c1ccccc1C

STK582823
Synonyms: 2- methyl- 5- {[(4- methylpyrimidin- 2- yl)sulfanyl]methyl}[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Cc1ccnc(n1)SCc1cc(O)n2c(n1)nc(n2)C

STK582824
Synonyms: 8- (3- chloro- 4- methoxyphenyl)- 1,7- dimethyl- 3- (2- methylprop- 2- en- 1- yl)- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: COc1ccc(cc1Cl)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CC(=C)C

STK582825
Synonyms: N- (2,4- dimethylphenyl)- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzenesulfonamide
Smiles: Cc1ccc(c(c1)C)N(S(=O)(=O)c1ccccc1)Cc1cc2ccc(cc2[nH]c1=O)C

STK582826
Synonyms: (4E)- 4- [(4- chlorophenyl)(hydroxy)methylidene]- 5- (2,4- dimethoxyphenyl)- 1- [3- (trifluoromethyl)phenyl]pyrrolidine- 2,3- dione
Smiles: COc1ccc(c(c1)OC)C1/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C(=O)N1c1cccc(c1)C(F)(F)F

STK582827
Synonyms: ethyl3- {[(3,4- dimethoxyphenyl)sulfonyl]amino}- 5- methoxy- 1H- indole- 2- carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NS(=O)(=O)c1ccc(c(c1)OC)OC)cc(cc2)OC

STK582829
Synonyms: N'- [2- (6- bromo- 2- methoxynaphthalen- 1- yl)acetyl]furan- 2- carbohydrazide
Smiles: COc1ccc2c(c1CC(=O)NNC(=O)c1ccco1)ccc(c2)Br

STK582830
Synonyms: methylN- {[4- (4- fluorophenyl)piperazin- 1- yl]carbonyl}- L- valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)N1CCN(CC1)c1ccc(cc1)F

STK582832
Synonyms: (3Z)- 3- [(2E)- 4- oxo- 3- (prop- 2- en- 1- yl)- 2- (1,3- thiazol- 2- ylimino)- 1,3- thiazolidin- 5- ylidene]- 1,3- dihydro- 2H- indol- 2- one
Smiles: C=CCN1/C(=N\c2nccs2)/S/C(=C/2\C(=O)Nc3c2cccc3)/C1=O

STK582834
Synonyms: N- [4- (diethylamino)phenyl]- 2- ({4- (4- methoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OC)COc1ccc(cc1)C)CC

STK582836
Synonyms: 3- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]- N- [2- (4- methoxyphenyl)ethyl]propanamide
Smiles: COc1ccc(cc1)CCNC(=O)CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK582838
Synonyms: N- (furan- 2- ylmethyl)- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]pyridine- 3- carboxamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(C(=O)c1cccnc1)Cc1ccco1

STK582840
Synonyms: N- benzyl- 5- methyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: O=C(c1nn2c(n1)c1c(nc2C)sc2c1CCC2)NCc1ccccc1

STK582841
Synonyms: 3- [4- (2- bromophenoxy)butyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1ccccc1Br

STK582843
Synonyms: 8- bromo- 7- {2- [(4,6- dimethylpyrimidin- 2- yl)sulfanyl]ethyl}- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Cc1cc(C)nc(n1)SCCn1c(Br)nc2c1c(O)nc(=O)n2C

STK582845
Synonyms: 2- (9- methoxy- 5- oxo- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 6(5H)- yl)- N- phenylacetamide
Smiles: COc1ccc2c(c1)c1nc3SCCn3c(=O)c1n2CC(=O)Nc1ccccc1

STK582848
Synonyms: (5E)- 1- butyl- 5- ({[3- (dimethylamino)propyl]amino}methylidene)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CCCCN1C(=NC(=O)/C(=C\NCCCN(C)C)/C1=O)S

STK582849
Synonyms: 2- [(4- amino- 5- cyclohexyl- 4H- 1,2,4- triazol- 3- yl)sulfanyl]- N- (2- bromo- 4,6- difluorophenyl)acetamide
Smiles: O=C(Nc1c(F)cc(cc1Br)F)CSc1nnc(n1N)C1CCCCC1

STK582851
Synonyms: N- [3- (4,11- dimethyl- 2- oxo- 6,7,8,9- tetrahydro- 2H- [1]benzofuro[3,2- g]chromen- 3- yl)propanoyl]- S- methyl- L- cysteine
Smiles: CSC[C@@H](C(=O)O)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc2c1CCCC2

STK582854
Synonyms: 3,7- bis(4- chlorophenyl)- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: Clc1ccc(cc1)C1=NOC2(C1)CC(=O)N(C2=O)c1ccc(cc1)Cl

STK582856
Synonyms: N'- (acridin- 9- yl)- 2- (naphthalen- 1- yl)acetohydrazide
Smiles: O=C(Cc1cccc2c1cccc2)NNc1c2ccccc2nc2c1cccc2

STK582858
Synonyms: 2- ({4- amino- 5- [5- (4- chlorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3- chloro- 4- fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK582859
Synonyms: 8- {[2- (dimethylamino)ethyl]amino}- 7- (2- hydroxy- 3- phenoxypropyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CN(CCNc1nc2c(n1CC(COc1ccccc1)O)c(=O)n(c(=O)n2C)C)C

STK582860
Synonyms: (5E)- 2- [4- (3- chloro- 4- methylphenyl)piperazin- 1- yl]- 5- {[5- (4- fluorophenyl)furan- 2- yl]methylidene}- 1,3- thiazol- 4(5H)- one
Smiles: Fc1ccc(cc1)c1ccc(o1)/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccc(c(c1)Cl)C

STK582862
Synonyms: 6- chloro- 4- ethyl- 2- oxo- 2H- chromen- 7- ylN- (tert- butoxycarbonyl)norvalinate
Smiles: CCCC(C(=O)Oc1cc2oc(=O)cc(c2cc1Cl)CC)NC(=O)OC(C)(C)C

STK582863
Synonyms: N- ethyl- N- [(2- hydroxyquinolin- 4- yl)methyl]acetamide
Smiles: CCN(C(=O)C)Cc1cc(O)nc2c1cccc2

STK582864
Synonyms: 2- (10- methoxy- 6- oxo- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 7(6H)- yl)- N- (3- methoxypropyl)acetamide
Smiles: COCCCNC(=O)Cn1c2ccc(cc2c2c1c(=O)n1c(n2)SCCC1)OC

STK582865
Synonyms: ethyl4- {1- methyl- 2,4- dioxo- 3- [(2E)- 3- phenylprop- 2- en- 1- yl]- 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)C/C=C/c1ccccc1

STK582867
Synonyms: (2E)- N- [7- (4- fluorophenyl)- 5- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]- 3- phenylprop- 2- enamide
Smiles: Fc1ccc(cc1)C1C=C(N=c2n1nc([nH]2)NC(=O)/C=C/c1ccccc1)c1ccccc1

STK582868
Synonyms: 10,10- dimethyl- N- (pyridin- 3- ylmethyl)- 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(nc2)sc2c1CC(C)(C)OC2)NCc1cccnc1

STK582869
Synonyms: (2S)- N- (3- methoxypropyl)- 2- (1- methyl- 2,4- dioxo- 1,4- dihydroquinazolin- 3(2H)- yl)- 3- phenylpropanamide
Smiles: COCCCNC(=O)[C@@H](n1c(=O)c2ccccc2n(c1=O)C)Cc1ccccc1

STK582870
Synonyms: methylN- [(3,5- dimethoxyphenyl)carbamoyl]- D- methioninate
Smiles: CSCC[C@H](C(=O)OC)NC(=O)Nc1cc(OC)cc(c1)OC

STK582872
Synonyms: N- (2- bromo- 4- methylphenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1Br)C)CSc1nnc(n1Cc1ccco1)Cc1cccs1

STK582873
Synonyms: 3- (2- fluorophenyl)- 3,4,7,8,9,10- hexahydro- 2H,6H- benzo[3,4]chromeno[8,7- e][1,3]oxazin- 6- one
Smiles: Fc1ccccc1N1COc2c(C1)c1oc(=O)c3c(c1cc2)CCCC3

STK582874
Synonyms: 2- amino- 1- (4- fluorophenyl)- N- (3- methylbutyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CC(CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)F)C

STK582875
Synonyms: 3- (4- tert- butylphenyl)- 4- ethyl- 5- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 4H- 1,2,4- triazole
Smiles: CCn1c(SC/C=C/c2ccccc2)nnc1c1ccc(cc1)C(C)(C)C

STK582876
Synonyms: N- [1- methyl- 4- oxo- 3- (3,4,5- trimethoxyphenyl)- 1,4- dihydroquinolin- 2- yl]thiophene- 2- carboxamide
Smiles: COc1cc(cc(c1OC)OC)c1c(NC(=O)c2cccs2)n(C)c2c(c1=O)cccc2

STK582877
Synonyms: 2- ethyl- 5- methyl- 3- phenylpyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCc1nn2c(c1c1ccccc1)nc(cc2O)C

STK582880
Synonyms: butyl[(3,4- dimethoxyphenyl)(hydroxy)methyl][4- (dimethylamino)phenyl]phosphinate
Smiles: CCCCOP(=O)(C(c1ccc(c(c1)OC)OC)O)c1ccc(cc1)N(C)C

STK582882
Synonyms: 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- [3- (propan- 2- yloxy)phenyl]- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CC(Oc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cccc1)C

STK582883
Synonyms: methylN- [(2- methoxybenzyl)carbamoyl]- L- valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)NCc1ccccc1OC

STK582889
Synonyms: 4- methyl- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- propylbenzenesulfonamide
Smiles: CCCN(S(=O)(=O)c1ccc(cc1)C)Cc1cc2ccc(cc2[nH]c1=O)C

STK582890
Synonyms: 3- (2- methoxyphenyl)- 8- (morpholin- 4- ium- 4- ylmethyl)- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- olate
Smiles: COc1ccccc1c1c(=O)c2ccc(c(c2oc1C(F)(F)F)C[NH+]1CCOCC1)[O-]

STK582896
Synonyms: 2- (6- ethyl- 1,3- benzothiazol- 2- yl)- 1- (2- fluorophenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccccc1F)c(=O)c1c(o2)cccc1

STK582897
Synonyms: methylN- [(2- methylcyclohexyl)carbamoyl]- L- valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)NC1CCCCC1C

STK582899
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(2- methoxyphenyl)carbonyl]- 2'- [(4- propoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: CCCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2OC)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK582901
Synonyms: N- [(2Z)- 3- (4- acetylphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]cyclopropanecarboxamide
Smiles: O=C(C1CC1)/N=C/1\SC2C(N1c1ccc(cc1)C(=O)C)CS(=O)(=O)C2

STK582902
Synonyms: 6- hydroxy- 3- methyl- 8- (4- methylpiperazin- 1- yl)- 7- {2- [(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]ethyl}- 3,7- dihydro- 2H- purin- 2- one
Smiles: CN1CCN(CC1)c1nc2c(n1CCSc1nnc(s1)C)c(O)nc(=O)n2C

STK582904
Synonyms: 4- {[(E)- (3,4- dimethoxyphenyl)methylidene]amino}- 5- (2- methoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(ccc1OC)/C=N/n1c(=S)[nH]nc1c1ccccc1OC

STK582905
Synonyms: (7- methyl- 6H- indolo[2,3- b]quinoxalin- 6- yl)aceticacid
Smiles: OC(=O)Cn1c2nc3ccccc3nc2c2c1c(C)ccc2

STK582906
Synonyms: 1- (4- fluorophenyl)- 2- ({5- [(4- methylphenoxy)methyl]- 4- phenyl- 4H- 1,2,4- triazol- 3- yl}sulfanyl)ethanone
Smiles: Cc1ccc(cc1)OCc1nnc(n1c1ccccc1)SCC(=O)c1ccc(cc1)F

STK582907
Synonyms: 2- phenyl- 1- [4- (propan- 2- yloxy)benzyl]- 5,6,7,8- tetrahydroquinazoline- 4(1H)- thione
Smiles: CC(Oc1ccc(cc1)Cn1c(nc(=S)c2c1CCCC2)c1ccccc1)C

STK582910
Synonyms: 7- (2- chlorobenzyl)- 10- fluoro- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 6(7H)- one
Smiles: Fc1ccc2c(c1)c1nc3SCCCn3c(=O)c1n2Cc1ccccc1Cl

STK582914
Synonyms: 2- {[5- (3- chlorophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- methoxy- 5- methylphenyl)acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl)C

STK582916
Synonyms: 3- cyclohexyl- 10- methyl- 2- propylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: CCCc1nc2c(c(=O)n1C1CCCCC1)c(=O)c1c(n2C)cccc1

STK582917
Synonyms: 5- (2- chlorophenyl)- 4- {[(E)- (4- ethoxy- 3- methoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1OC)/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

STK582918
Synonyms: 8,8- dimethyl- 6- (4- nitrophenyl)- 3,4a,7a,8- tetrahydropyrrolo[3',4':5,6]thiopyrano[2,3- d][1,3]thiazole- 2,5,7(6H)- trione
Smiles: O=c1[nH]c2c(s1)C(C)(C)C1C(S2)C(=O)N(C1=O)c1ccc(cc1)[N+](=O)[O-]

STK582919
Synonyms: N- [(2Z)- 4- (4- bromophenyl)- 1,3- thiazol- 2(3H)- ylidene]- 2,2,3,3,4,4,4- heptafluorobutanamide
Smiles: O=C(C(C(C(F)(F)F)(F)F)(F)F)/N=c/1\scc([nH]1)c1ccc(cc1)Br

STK582921
Synonyms: 2- (2- cyanophenoxy)- N'- [(E)- pyridin- 3- ylmethylidene]acetohydrazide
Smiles: N#Cc1ccccc1OCC(=O)N/N=C/c1cccnc1

STK582922
Synonyms: 2- ({4- amino- 5- [5- (4- methylphenyl)- 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)C

STK582924
Synonyms: 5- (2- fluorophenyl)- 4- {[(E)- pyridin- 3- ylmethylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccccc1c1n[nH]c(=S)n1/N=C/c1cccnc1

STK582926
Synonyms: N- [3- (4- chlorophenyl)- 1- methyl- 4- oxo- 1,4- dihydroquinolin- 2- yl]propanamide
Smiles: CCC(=O)Nc1c(c2ccc(cc2)Cl)c(=O)c2c(n1C)cccc2

STK582927
Synonyms: N- (2,4- dimethoxyphenyl)- 2- {[4- (4- methylphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK582928
Synonyms: 1,1',3- trimethyl- 6'- nitro- 2'- propyl- 1',4'- dihydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinoline]- 2,4,6(1H,3H)- trione
Smiles: CCCC1N(C)c2ccc(cc2CC21C(=O)N(C)C(=O)N(C2=O)C)[N+](=O)[O-]

STK582929
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(2,4- dichlorophenyl)carbonyl]- 2'- (thiophen- 2- ylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Clc1ccc(c(c1)Cl)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccs1)C(=O)Nc1c2cccc1)cccc3

STK582930
Synonyms: 4- {[(E)- (2- chloro- 6- fluorophenyl)methylidene]amino}- 5- (2- fluorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1cccc(c1/C=N/n1c(=S)[nH]nc1c1ccccc1F)Cl

STK582931
Synonyms: N- [6- chloro- 3- (naphthalen- 1- yl)- 4- oxo- 4H- chromen- 2- yl]- 2- phenylacetamide
Smiles: O=C(Nc1oc2ccc(cc2c(=O)c1c1cccc2c1cccc2)Cl)Cc1ccccc1

STK582932
Synonyms: 1- {(2E)- 2- [(2- chloro- 6- 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/c1cc3cc(C)ccc3nc1Cl)c1ccccc1n2

STK582933
Synonyms: [1- amino- 8,8- dimethyl- 5- (pyrrolidin- 1- yl)- 8,9- dihydro- 6H- pyrano[4,3- d]thieno[2,3- b]pyridin- 2- yl](phenyl)methanone
Smiles: O=C(c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCCC1)c1ccccc1

STK582934
Synonyms: 4- ({[5- (3- methoxyphenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}methyl)benzonitrile
Smiles: C=CCn1c(SCc2ccc(cc2)C#N)nnc1c1cccc(c1)OC

STK582935
Synonyms: (E)- [3- fluoro- 4- (propan- 2- yloxy)phenyl]{1- [2- (morpholin- 4- ium- 4- yl)ethyl]- 4,5- dioxo- 2- [4- (propan- 2- yl)phenyl]pyrrolidin- 3- ylidene}methanolate
Smiles: CC(Oc1ccc(cc1F)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)CC[NH+]1CCOCC1)/[O-])C

STK582936
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [2- (propan- 2- yl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(C)C)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK582937
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- cyclohex- 3- en- 1- ylmethylidene]- 5- (4- propoxyphenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/C1CCC=CC1

STK582939
Synonyms: 7- chloro- 2- (2- hydroxy- 2- phenylethyl)- 1- (3- methoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cccc(c1)C1N(CC(c2ccccc2)O)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK582941
Synonyms: (2E,5Z)- 2- [(3- methylphenyl)imino]- 5- [(1- methyl- 1H- pyrrol- 2- yl)methylidene]- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: Cc1cccc(c1)/N=C\1/S/C(=C\c2cccn2C)/C(=N1)O

STK582942
Synonyms: (4E)- 4- [(4- ethoxyphenyl)(hydroxy)methylidene]- 5- (2- fluorophenyl)- 1- (4- methoxyphenyl)pyrrolidine- 2,3- dione
Smiles: CCOc1ccc(cc1)/C(=C\1/C(c2ccccc2F)N(C(=O)C1=O)c1ccc(cc1)OC)/O

STK582943
Synonyms: 7- (3- hydroxypropyl)- 1,3- dimethyl- 8- [(4- phenylpiperazin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCCCn1c(CN2CCN(CC2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK582944
Synonyms: 4- (2- methoxydibenzo[b,d]furan- 3- yl)- 5- (quinolin- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc2c(cc1n1c(=S)[nH]nc1c1ccc3c(n1)cccc3)oc1c2cccc1

STK582945
Synonyms: N- butyl- 3- methyl- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzamide
Smiles: CCCCN(C(=O)c1cccc(c1)C)Cc1cc2ccccc2[nH]c1=O

STK582946
Synonyms: 1',3'- diethyl- 3- phenyl- 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)c1ccccc1

STK582948
Synonyms: 7- (4- benzylpiperazin- 1- yl)- 4- (propan- 2- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: CC(c1nc2oc3c(c2c2c1CCC2)ncnc3N1CCN(CC1)Cc1ccccc1)C

STK582949
Synonyms: (4E)- 6- {[4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]methyl}- 4- [(2,4- dimethylphenyl)imino]- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: Cc1ccc(c(c1)C)/N=c/1\[nH]c(CN2CCN(CC2)Cc2ccc3c(c2)OCO3)nc(n1)N

STK582950
Synonyms: 5- (2,3- dichlorophenyl)- 2- (3- phenoxyphenyl)- 4- phenyl- 1H- imidazole
Smiles: Clc1c(Cl)cccc1c1[nH]c(nc1c1ccccc1)c1cccc(c1)Oc1ccccc1

STK582953
Synonyms: 8- (3- chlorophenyl)- 11- (4- methoxyphenyl)- 10- methyl- 2- (pyridin- 4- yl)- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccc(cc1)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1ccncc1)c1cccc(c1)Cl

STK582954
Synonyms: 2- (benzylsulfanyl)- 5- methyl- 6- (3- methylbenzyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Cc1cccc(c1)Cc1c(C)nc2n(c1O)nc(n2)SCc1ccccc1

STK582955
Synonyms: 6'- hydroxy- 2,4- dimethyl- 8- nitro- 3'- propyl- 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: CCCN1C(=O)N=C(C2(C1=O)Cc1cc(ccc1N1C2C(C)OC(C1)C)[N+](=O)[O-])O

STK582956
Synonyms: 2- [3- (4- chlorophenyl)- 5- methyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl]- N- (3- hydroxypropyl)acetamide
Smiles: OCCCNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)Cl

STK582957
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(4- nitrophenyl)carbonyl]- 2'- (phenylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1)C(=O)Nc1c2cccc1)cccc3)c1ccc(cc1)[N+](=O)[O-]

STK582958
Synonyms: 8- (4- ethoxyphenyl)- 1,6,7- trimethyl- 3- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: CCOc1ccc(cc1)n1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CCN1CCCCC1

STK582959
Synonyms: (4E)- 4- [hydroxy(4- methoxyphenyl)methylidene]- 1,5- bis(4- methoxyphenyl)pyrrolidine- 2,3- dione
Smiles: COc1ccc(cc1)C1/C(=C(/c2ccc(cc2)OC)\O)/C(=O)C(=O)N1c1ccc(cc1)OC

STK582960
Synonyms: 2- (1,3- benzothiazol- 2- yl)- 1- (4- methoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(cc1)C1N(c2nc3c(s2)cccc3)C(=O)c2c1c(=O)c1c(o2)cccc1

STK582961
Synonyms: N- (4- chlorophenyl)- 2- ({4- (furan- 2- ylmethyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)C

STK582962
Synonyms: 2- {[10,10- dimethyl- 5- (methylsulfanyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)Nc1cccc(c1)C)nn2)CC(OC3)(C)C

STK582963
Synonyms: (4E)- 2- (3,5- dimethylphenyl)- 4- {[(1,1- dioxidotetrahydrothiophen- 3- yl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: Cc1cc(C)cc(c1)N1C(=O)/C(=C/NC2CCS(=O)(=O)C2)/c2c(C1=O)cccc2

STK582965
Synonyms: (8S,8aR,11aS)- 10- (5- chloro- 2- methoxyphenyl)- 8- (phenylcarbonyl)- 11a,11b- dihydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 9,11(8aH,10H)- dione
Smiles: COc1ccc(cc1N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)c2ccccc2)C=Cc2c1cccc2)Cl

STK582966
Synonyms: 7- (3,4- dichlorobenzyl)- 8- [(2- ethylpiperidin- 1- yl)methyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCC1CCCCN1Cc1nc2c(n1Cc1ccc(c(c1)Cl)Cl)c(=O)n(c(=O)n2C)C

STK582968
Synonyms: 7- (3- chlorophenyl)- 2- (4- ethylphenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CCc1ccc(cc1)c1nn2c(n1)c1cnn(c1nc2)c1cccc(c1)Cl

STK582970
Synonyms: 2- {[5- (2- chlorophenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [4- (dimethylamino)phenyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)N(C)C)nnc1c1ccccc1Cl

STK582971
Synonyms: N- (3,4- dimethoxyphenyl)- 2- {[4- (prop- 2- en- 1- yl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)OC)OC)nnc1Cc1cccs1

STK582973
Synonyms: 2- (4- ethylphenyl)- 4- (phenylcarbonyl)hexahydropyrrolo[3,4- a]pyrrolizine- 1,3(2H,4H)- dione
Smiles: CCc1ccc(cc1)N1C(=O)C2C(C1=O)C1N(C2C(=O)c2ccccc2)CCC1

STK582974
Synonyms: N- (3,4- dimethylphenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)C)C)CSc1nnc(n1Cc1ccco1)Cc1cccs1

STK582975
Synonyms: 2,2,5- trimethyl- 8- (2- methylpiperidin- 1- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: CC1CCCCN1c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C

STK582976
Synonyms: 4- {[(E)- biphenyl- 4- ylmethylidene]amino}- 5- (4- fluorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)c1ccccc1

STK582977
Synonyms: N- benzyl- 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)NCc1ccccc1

STK582980
Synonyms: (4E)- 5- [3- (benzyloxy)phenyl]- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 1- (1,3- thiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: CC1Cc2c(O1)ccc(c2)/C(=C\1/C(c2cccc(c2)OCc2ccccc2)N(C(=O)C1=O)c1nccs1)/O

STK582981
Synonyms: (2Z)- 7- {[bis(2- methoxyethyl)ammonio]methyl}- 2- (2- ethoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: COCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccccc1OCC)/C2=O)CCOC

STK582982
Synonyms: 4- [(E)- [2- (3,4- dichlorophenyl)- 1- (3- methoxypropyl)- 4,5- dioxopyrrolidin- 3- ylidene](hydroxy)methyl]- N,N- dimethylbenzenesulfonamide
Smiles: COCCCN1C(c2ccc(c(c2)Cl)Cl)/C(=C(/c2ccc(cc2)S(=O)(=O)N(C)C)\O)/C(=O)C1=O

STK582983
Synonyms: (3a'S,6a'R)- 6- chloro- 5'- cycloheptyl- 7- methyl- 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)C1CCCCCC1)C(=O)Nc1c2ccc(c1C)Cl

STK582984
Synonyms: 3- (2- chlorophenyl)- 5- [(4- methylbenzyl)sulfanyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazole
Smiles: Cc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)C)c1ccccc1Cl

STK582985
Synonyms: 1- amino- N- (furan- 2- ylmethyl)- 8,8- dimethyl- 5- (pyrrolidin- 1- yl)- 8,9- dihydro- 6H- pyrano[4,3- d]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCCC1)NCc1ccco1

STK582988
Synonyms: 7- hydroxy- 1- methyl- 9- (4- methylphenyl)- 3- pentyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: CCCCCn1c(=O)n(C)c2c(c1=O)n1CC(O)CN(c1n2)c1ccc(cc1)C

STK582989
Synonyms: 2- ({4- amino- 5- [5- (4- methylphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [2- (propan- 2- yl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(C)C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK582990
Synonyms: N- (3,4- dimethoxyphenyl)- 2- {[4- (4- methylphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK582992
Synonyms: 5,6- dimethoxy- N- (2- phenylethyl)- 1H- indole- 2- carboxamide
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)NCCc1ccccc1

STK582994
Synonyms: N- [2- (diethylamino)ethyl]- 5- methyl- 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)sc2c1CCCC2)CC

STK582995
Synonyms: 6''- amino- 3''- ethyl- 2''H- dispiro[1,3- dioxolane- 2,1'- cyclohexane- 4',4''- pyrano[2,3- c]pyrazole]- 5''- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31CCC1(CC3)OCCO1)c(CC)[nH]n2

STK582997
Synonyms: N- (2,5- dimethylphenyl)- 2- {[4- (4- methylphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(C)ccc1C)CSc1nnc(n1c1ccc(cc1)C)Cc1cccs1

STK582999
Synonyms: 6- ethyl- 10- methyl- 3- [4- (trifluoromethyl)phenyl]- 3,4- dihydro- 2H,8H- chromeno[6,7- e][1,3]oxazin- 8- one
Smiles: CCc1cc(=O)oc2c1cc1CN(COc1c2C)c1ccc(cc1)C(F)(F)F

STK583000
Synonyms: 7- bromo- 1- (2- fluorophenyl)- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Brc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccc1F)c1noc(c1)C

STK583001
Synonyms: 3- (3- chlorophenyl)- 5- [(2,6- dichlorobenzyl)sulfanyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazole
Smiles: Cc1ccc(cc1)n1c(nnc1c1cccc(c1)Cl)SCc1c(Cl)cccc1Cl

STK583002
Synonyms: (1Z)- 1- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 1(2H)- ylidene)- 4- [4- (morpholin- 4- ylsulfonyl)phenyl]butan- 2- one
Smiles: COc1cc2/C(=C/C(=O)CCc3ccc(cc3)S(=O)(=O)N3CCOCC3)/NCCc2cc1OC

STK583003
Synonyms: (2Z)- 5- benzyl- 2- (phenylimino)- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: OC1=N/C(=N/c2ccccc2)/SC1Cc1ccccc1

STK583004
Synonyms: N- [(2- methylphenyl)carbamoyl]- L- methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)Nc1ccccc1C

STK583008
Synonyms: 6- (4- methylphenyl)- 9- (pyridin- 3- yl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Cc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2cccnc2)ncn3)C1)O

STK583011
Synonyms: 3- [(2E)- 2- (quinoxalin- 5- ylmethylidene)hydrazinyl]- 5H- [1,2,4]triazino[5,6- b]indole
Smiles: c1cnc2c(n1)c(/C=N/Nc1nnc3c(n1)[nH]c1c3cccc1)ccc2

STK583014
Synonyms: [1- (4- chlorophenyl)cyclopentyl](7- methylidene- 3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)methanone
Smiles: Clc1ccc(cc1)C1(CCCC1)C(=O)N1CCc2c(C1=C)cc1c(c2)OCCCO1

STK583015
Synonyms: 4- ({(E)- [4- (benzyloxy)- 3- methoxyphenyl]methylidene}amino)- 5- (2- chlorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(ccc1OCc1ccccc1)/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

STK583016
Synonyms: (5- bromofuran- 2- yl)(5- methylidene- 7,8- dihydro[1,3]dioxolo[4,5- g]isoquinolin- 6(5H)- yl)methanone
Smiles: Brc1ccc(o1)C(=O)N1CCc2c(C1=C)cc1c(c2)OCO1

STK583017
Synonyms: N- [(2Z)- 3- (3,5- dimethylphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]butanamide
Smiles: CCCC(=O)/N=C/1\SC2C(N1c1cc(C)cc(c1)C)CS(=O)(=O)C2

STK583018
Synonyms: 7- fluoro- 1- (4- fluorophenyl)- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Fc1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK583019
Synonyms: (4E)- 5- (4- butoxy- 3- ethoxyphenyl)- 1- {5- [(2- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]pyrrolidine- 2,3- dione
Smiles: CCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccccc1Cl

STK583020
Synonyms: N- [4- chloro- 3- (trifluoromethyl)phenyl]- 2- {[5- (3- methylphenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)C(F)(F)F)Cl)nnc1c1cccc(c1)C

STK583021
Synonyms: 3- benzyl- 2- cyclohexyl- 8- methoxy- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COc1ccc2c(c1)oc1c(c2=O)c(=O)n(c(n1)C1CCCCC1)Cc1ccccc1

STK583022
Synonyms: 3- chloro- N- {(1Z)- 1- [1- cyano- 2- (cyclopentylamino)- 2- oxoethylidene]- 1H- isoindol- 3- yl}benzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1cccc(c1)Cl)/C(=O)NC1CCCC1

STK583023
Synonyms: N- (3,5- dichlorophenyl)- 2- {[4- (4- methoxyphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(Cl)cc(c2)Cl)nnc1Cc1cccs1

STK583024
Synonyms: 3- (3- chlorophenyl)- 5- [(3- fluorobenzyl)sulfanyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazole
Smiles: Cc1ccc(cc1)n1c(SCc2cccc(c2)F)nnc1c1cccc(c1)Cl

STK583025
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(4- chlorophenyl)carbonyl]- 2'- [(3- propoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: CCCOc1cccc(c1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK583026
Synonyms: 1,4- dimethyl- 6- (4- methylpiperazin- 1- yl)- 2- oxo- 5- {(Z)- [4- oxo- 3- (prop- 2- en- 1- yl)- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 1,2- dihydropyridine- 3- carbonitrile
Smiles: C=CCN1C(=S)S/C(=C\c2c(N3CCN(CC3)C)n(C)c(=O)c(c2C)C#N)/C1=O

STK583027
Synonyms: 3- [2- (4- methoxyphenyl)ethyl]- 2- methyl- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: COc1ccc(cc1)CCn1c(C)nc2c(c1=O)c(=O)c1c(o2)cccc1

STK583028
Synonyms: N- [(2- chlorobenzyl)carbamoyl]- D- alanine
Smiles: O=C(N[C@@H](C(=O)O)C)NCc1ccccc1Cl

STK583029
Synonyms: 1- methyl- 8- (2- methylphenyl)- 3- (2- methylpropyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CC(Cn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1C)C

STK583031
Synonyms: 8- [(2E)- 2- (4- ethoxybenzylidene)hydrazinyl]- 7- (4- fluorobenzyl)- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCOc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1ccc(cc1)F)c(O)nc(=O)n2C

STK583032
Synonyms: 7- butyl- 1,3- dimethyl- 8- (piperidin- 1- ylmethyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCn1c(CN2CCCCC2)nc2c1c(=O)n(c(=O)n2C)C

STK583033
Synonyms: 4- [({4- phenyl- 1- [3- (3,5,9- trimethyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)propanoyl]piperidin- 4- yl}carbonyl)amino]butanoicacid
Smiles: OC(=O)CCCNC(=O)C1(CCN(CC1)C(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C)c1ccccc1

STK583036
Synonyms: 2- {[4- (4- methylphenyl)- 5- (pyridin- 2- yl)- 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)nnc1c1ccccn1

STK583038
Synonyms: (2Z)- N- (4- ethoxyphenyl)- 2- (3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 7(8H)- ylidene)ethanamide
Smiles: CCOc1ccc(cc1)NC(=O)/C=C/1\NCCc2c1cc1OCCCOc1c2

STK583039
Synonyms: 8- methoxy- 4- methyl- 6- oxo- 6H- benzo[c]chromen- 3- ylN- [(benzyloxy)carbonyl]- L- isoleucinate
Smiles: CC[C@H]([C@@H](C(=O)Oc1ccc2c(c1C)oc(=O)c1c2ccc(c1)OC)NC(=O)OCc1ccccc1)C

STK583043
Synonyms: 2- [(4- methyl- 6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 3- yl)oxy]- N- [3- (morpholin- 4- yl)propyl]acetamide
Smiles: O=C(COc1ccc2c(c1C)oc(=O)c1c2CCCC1)NCCCN1CCOCC1

STK583044
Synonyms: 2- (4- benzylpiperazin- 1- yl)- 6- (propan- 2- yl)pyrimidin- 4- ol
Smiles: Oc1nc(nc(c1)C(C)C)N1CCN(CC1)Cc1ccccc1

STK583049
Synonyms: 7- chloro- 6- methyl- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- phenyl- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccccc1)c(=O)c1c(o2)cc(c(c1)Cl)C

STK583051
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1N)c1cc([nH]n1)c1ccc(cc1)F

STK583052
Synonyms: 7'- ({(1E)- 1- [2- hydroxy- 4,6- dioxo- 1- (prop- 2- en- 1- yl)- 1,6- dihydropyrimidin- 5(4H)- ylidene]propyl}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
Smiles: C=CCN1C(=NC(=O)/C(=C(\Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/CC)/C1=O)O

STK583054
Synonyms: 6- chloro- N- [(2Z)- 5- [(2- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]- 7- methyl- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cc(c(c2)Cl)C)/N=c\1/[nH]nc(s1)SCc1ccccc1Cl

STK583058
Synonyms: (5Z)- 5- [5- (3,4- dimethoxyphenyl)pyrazolidin- 3- ylidene]- 6- hydroxy- 3- (2- phenylethyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1cc(ccc1OC)C1NN/C(=C\2/C(=NC(=O)N(C2=O)CCc2ccccc2)O)/C1

STK583059
Synonyms: 7- (4- fluorobenzyl)- 8- [(2E)- 2- (4- fluorobenzylidene)hydrazinyl]- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Fc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1ccc(cc1)F)c(O)nc(=O)n2C

STK583060
Synonyms: 5- (3- chlorophenyl)- 4- {[(E)- (2- methoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccccc1/C=N/n1c(=S)[nH]nc1c1cccc(c1)Cl

STK583064
Synonyms: (4E)- 2- (4- methoxyphenyl)- 4- ({[2- (4- methoxyphenyl)ethyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc(cc1)CCN/C=C\1/C(=O)N(c2ccc(cc2)OC)C(=O)c2c1cccc2

STK583065
Synonyms: 3- butyl- 7- chloro- 2- (2- methylphenyl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: CCCCn1c(nc2c(c1=O)c(=O)c1c(o2)ccc(c1)Cl)c1ccccc1C

STK583066
Synonyms: 1- (6- {[3- (3,5,9- trimethyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl)propanoyl]amino}hexanoyl)piperidine- 4- carboxylicacid
Smiles: O=C(CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C)NCCCCCC(=O)N1CCC(CC1)C(=O)O

STK583067
Synonyms: 2- hydroxy- N- (2- methoxy- 5- methylphenyl)- 7- (4- methoxyphenyl)- 5- oxo- 3,4,5,6,7,8- hexahydroquinoline- 4- carboxamide
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)N=C(CC2C(=O)Nc1cc(C)ccc1OC)O

STK583069
Synonyms: 3- [(Z)- (3- hexyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 7- methyl- 2- (4- phenylpiperazin- 1- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2)/C1=O

STK583070
Synonyms: (3a'S,6a'R)- 5- chloro- 5'- cyclopentyl- 7- methyl- 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)C1CCCC1)C(=O)Nc1c2cc(Cl)cc1C

STK583071
Synonyms: N- [(2Z)- 1,3- benzothiazol- 2(3H)- ylidene]- 4- (4- oxoquinazolin- 3(4H)- yl)butanamide
Smiles: O=C(/N=c/1\sc2c([nH]1)cccc2)CCCn1cnc2c(c1=O)cccc2

STK583075
Synonyms: N- [7- (4- fluorophenyl)- 5- phenyl- 4,5,6,7- tetrahydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]benzenesulfonamide
Smiles: Fc1ccc(cc1)C1CC(Nc2n1nc(n2)NS(=O)(=O)c1ccccc1)c1ccccc1

STK583077
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(2- methoxyphenyl)carbonyl]- 2'- [(4- methoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccccc2OC)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK583078
Synonyms: N- (2,5- dimethylphenyl)- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]furan- 2- carboxamide
Smiles: Cc1ccc(c(c1)N(C(=O)c1ccco1)Cc1cc2ccccc2[nH]c1=O)C

STK583079
Synonyms: 4- butyl- 2- oxo- 2H- chromen- 7- ylN- [(4- methylphenyl)sulfonyl]- L- valinate
Smiles: CCCCc1cc(=O)oc2c1ccc(c2)OC(=O)[C@H](C(C)C)NS(=O)(=O)c1ccc(cc1)C

STK583080
Synonyms: (3S,3a'R,6a'S)- 5- chloro- 3'- (1H- indol- 3- ylmethyl)- 5'- (tetrahydrofuran- 2- 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: Clc1ccc2c(c1)[C@]1(NC([C@H]3[C@@H]1C(=O)N(C3=O)CC1CCCO1)Cc1c[nH]c3c1cccc3)C(=O)N2

STK583081
Synonyms: 5- (4- methoxyphenyl)- 4- ({(E)- [2- (trifluoromethyl)phenyl]methylidene}amino)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccccc1C(F)(F)F

STK583082
Synonyms: N- {[6- chloro- 8- (trifluoromethyl)[1,2,4]triazolo[4,3- a]pyridin- 3- yl]methyl}- 2- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)CC(=O)NCc1nnc2n1cc(Cl)cc2C(F)(F)F

STK583083
Synonyms: 3- [4- (4- benzylpiperidin- 1- yl)phenyl]tetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- imine5,5- dioxide
Smiles: N=C1SC2C(N1c1ccc(cc1)N1CCC(CC1)Cc1ccccc1)CS(=O)(=O)C2

STK583085
Synonyms: 4- {[(E)- (2- methoxynaphthalen- 1- yl)methylidene]amino}- 5- (3- methoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc2c(c1/C=N/n1c(=S)[nH]nc1c1cccc(c1)OC)cccc2

STK583087
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (3- ethoxy- 4- hydroxyphenyl)- 5- (furan- 2- ylmethyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: CCOc1cc(ccc1O)C1N(Cc2ccco2)C(=O)c2c1c([nH]n2)c1cc(Cl)c(cc1O)C

STK583088
Synonyms: (3R)- N- [(2S)- 1- (cycloheptylamino)- 3- methyl- 1- oxobutan- 2- yl]- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: CC([C@@H](C(=O)NC1CCCCCC1)NC(=O)[C@@H]1CSC2N1C(=O)c1c2cccc1)C

STK583089
Synonyms: 5- (2- ethyl- 2,3,4,9- tetrahydro- 1H- beta- carbolin- 1- yl)- 6- hydroxy- 1- (naphthalen- 1- yl)pyrimidine- 2,4(1H,3H)- dione
Smiles: CCN1CCc2c(C1c1c(=O)[nH]c(=O)n(c1O)c1cccc3c1cccc3)[nH]c1c2cccc1

STK583090
Synonyms: 3- [(2,5- dimethylbenzyl)sulfanyl]- 4- (furan- 2- ylmethyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazole
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCc1cc(C)ccc1C

STK583091
Synonyms: 1- ({3- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]phenyl}carbonyl)piperidine- 4- carboxylicacid
Smiles: O=C(c1cccc(c1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)N1CCC(CC1)C(=O)O

STK583092
Synonyms: tert- butyl(3S)- 3- ({2- [(2- methoxy- 5- methylphenyl)amino]- 2- oxoethyl}carbamoyl)- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: COc1ccc(cc1NC(=O)CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C

STK583093
Synonyms: {2- [(E)- {[3- (4- methoxyphenyl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]imino}methyl]phenoxy}aceticacid
Smiles: COc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccccc1OCC(=O)O

STK583094
Synonyms: N- [(2- hydroxypropyl)carbamoyl]- D- leucine
Smiles: CC(CNC(=O)N[C@@H](C(=O)O)CC(C)C)O

STK583098
Synonyms: 4- {[(E)- (2- chlorophenyl)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/c1ccccc1Cl)C

STK583100
Synonyms: 10- (4- chlorophenyl)- 1,3- dimethyl- 5- phenyl- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: Clc1ccc(cc1)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1ccccc1)C

STK583102
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (3- ethoxyphenyl)- 1H- 1,2,3- triazole- 4- carboxylicacid
Smiles: CCOc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)O

STK583105
Synonyms: 9- (3,5- difluorophenyl)- 2- methyl- 6- (4- methylphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Cc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2cc(F)cc(c2)F)nc(n3)C)C1)O

STK583109
Synonyms: 1- [10- (4- methoxyphenyl)- 8- methyl- 2- (pyridin- 2- yl)- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- yl]ethanone
Smiles: COc1ccc(cc1)C1C(=C(C)Oc2c1c1nc(nn1cn2)c1ccccn1)C(=O)C

STK583110
Synonyms: 2- ethyl- 3- (4- fluorophenyl)- 4H- thiochromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: CCc1nc2sc3ccccc3c(=O)c2c(=O)n1c1ccc(cc1)F

STK583111
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- ethyl- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [4- (diethylamino)phenyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)N(CC)CC)nnc1COc1ccc(cc1)Cl

STK583112
Synonyms: 4- (2- methylpropyl)- 7- (morpholin- 4- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: CC(Cc1nc2oc3c(c2c2c1CCC2)ncnc3N1CCOCC1)C

STK583113
Synonyms: 4- [(2E)- 2- (quinolin- 8- ylmethylidene)hydrazinyl]- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine
Smiles: N(=C\c1cccc2c1nccc2)/Nc1ncnc2c1c1CCCCc1s2

STK583114
Synonyms: (2E)- 1- (2- hydroxy- 4- phenylquinolin- 3- yl)- 3- (quinolin- 7- yl)prop- 2- en- 1- one
Smiles: O=C(c1c(O)nc2c(c1c1ccccc1)cccc2)/C=C/c1ccc2c(c1)nccc2

STK583116
Synonyms: ethyl4- (8- ethyl- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- yl)piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1nc2nnnn2c2c1c1CCN(Cc1s2)CC

STK583118
Synonyms: 5- butyl- 3- (4- methoxyphenyl)- 3H- pyrrolo[2',3':4,5]pyrimido[1,6- a]benzimidazol- 1- ylpentanoate
Smiles: CCCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCCC)cccc3)c1ccc(cc1)OC

STK583121
Synonyms: (Z)- N- {[11- (4- chlorophenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}- 1- (4- methoxyphenyl)methanimine
Smiles: COc1ccc(cc1)/C=N\OCc1nn2c(n1)c1c(nc2)Oc2c(C1c1ccc(cc1)Cl)c(C)nn2c1ccccc1

STK583123
Synonyms: 4- (4- chlorophenoxy)- 2- [4- (propan- 2- yloxy)phenyl]quinazoline
Smiles: CC(Oc1ccc(cc1)c1nc(Oc2ccc(cc2)Cl)c2c(n1)cccc2)C

STK583126
Synonyms: [(2Z)- 2- [(1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)imino]- 3- {[(E)- (2- hydroxyphenyl)methylidene]amino}- 4- oxo- 1,3- thiazolidin- 5- yl]aceticacid
Smiles: OC(=O)CC1S/C(=N\c2c(C)n(n(c2=O)c2ccccc2)C)/N(C1=O)/N=C/c1ccccc1O

STK583127
Synonyms: 4- (propan- 2- yl)- N- [3- (propan- 2- yloxy)propyl]- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 7- amine
Smiles: CC(OCCCNc1ncnc2c1oc1c2c2CCCc2c(n1)C(C)C)C

STK583128
Synonyms: (3aR,6aS)- 5- (5- chloro- 2- methoxyphenyl)- 3- (2,5- dimethoxyphenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: COc1ccc(c(c1)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1cc(Cl)ccc1OC)OC

STK583129
Synonyms: 5- (2- chlorophenyl)- 4- {[(1E,2E)- 3- phenylprop- 2- en- 1- ylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccccc1c1n[nH]c(=S)n1/N=C/C=C/c1ccccc1

STK583130
Synonyms: 16- (3,4- diethoxyphenyl)- 3,3- dimethyl- 2,3,4,6,7,11,12,16- octahydro- 1H,10H- [1,4]dioxepino[2',3':6,7]isoquino[2,1- a]quinolin- 1- one
Smiles: CCOc1cc(ccc1OCC)C1C=C2N(C3=C1C(=O)CC(C3)(C)C)CCc1c2cc2OCCCOc2c1

STK583131
Synonyms: 4- ({(E)- [4- (diethylamino)phenyl]methylidene}amino)- 5- (3- methylphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCN(c1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)C)CC

STK583132
Synonyms: 2- ({4- (4- chlorophenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- ethylphenyl)acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccc(cc1)C

STK583133
Synonyms: (4E)- 1- [5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- (3- hydroxyphenyl)pyrrolidine- 2,3- dione
Smiles: Oc1cccc(c1)C1N(c2nnc(s2)SCc2ccccc2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK583135
Synonyms: 2- [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]naphthalen- 1- ol
Smiles: Cc1nn(c2c1C(c1cccnc1)c1c(O2)ncn2c1nc(n2)c1ccc2c(c1O)cccc2)c1ccccc1

STK583137
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3- methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)Cl

STK583138
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- (4- ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc2n1c(Nc1ccc(cc1)C)c(C#N)c1c2COC(C1)(C)C

STK583140
Synonyms: N- [(2Z)- 3- (3,4- dichlorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]tetrahydrofuran- 2- carboxamide
Smiles: O=C(C1CCCO1)/N=C/1\SC2C(N1c1ccc(c(c1)Cl)Cl)CS(=O)(=O)C2

STK583142
Synonyms: N- cyclopropyl- 3- [3- (4- fluorophenyl)- 5,9- dimethyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl]propanamide
Smiles: O=C(NC1CC1)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)F

STK583143
Synonyms: 2- [(3aR,4R,4aR,7aS,8R,8aR)- 3- (2- 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]- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carbonitrile
Smiles: N#Cc1c(sc2c1CCCC2)N1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1C[C@H]2[C@H]2[C@@H]1ON=C2c1ccccc1Cl

STK583144
Synonyms: 1- benzyl- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 9- methyl- 4- oxo- 1,4- dihydropyrido[1,2- a]pyrrolo[2,3- d]pyrimidine- 2- carboxamide
Smiles: O=C(c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C)NC1CCS(=O)(=O)C1

STK583145
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (2- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- ethylphenyl)acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccc1OC

STK583146
Synonyms: 7'- {(E)- [1- (4- ethoxyphenyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}- 1,3- dimethyl- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- trion
Smiles: CCOc1ccc(cc1)N1C(=O)N=C(/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK583148
Synonyms: (3aR,6aS)- 3- (3,4- dimethoxyphenyl)- 5- (2,3- dimethylphenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: COc1cc(ccc1OC)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1C)C

STK583149
Synonyms: 2- [4- (2- methoxyphenyl)piperazin- 1- yl]- 5,6- dimethylpyrimidin- 4- ol
Smiles: COc1ccccc1N1CCN(CC1)c1nc(C)c(c(n1)O)C

STK583150
Synonyms: 1- (3,4- diethoxyphenyl)- 2- (6- fluoro- 1,3- benzothiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1cc(ccc1OCC)C1N(c2sc3c(n2)ccc(c3)F)C(=O)c2c1c(=O)c1c(o2)cccc1

STK583151
Synonyms: (4E)- 2- (2- methoxyphenyl)- 4- {[(3- methylbutyl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccccc1N1C(=O)/C(=C/NCCC(C)C)/c2c(C1=O)cccc2

STK583154
Synonyms: (2Z)- 1- (4- tert- butylphenyl)- 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 1(2H)- ylidene)ethanone
Smiles: COc1cc2/C(=C/C(=O)c3ccc(cc3)C(C)(C)C)/NCCc2cc1OC

STK583155
Synonyms: N,N- diethyl- 2- {[4- (4- methylphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCN(C(=O)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1)CC

STK583156
Synonyms: 1- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 5- oxo- N- [(2S)- 1- oxo- 1- (pentylamino)propan- 2- yl]pyrrolidine- 3- carboxamide
Smiles: CCCCCNC(=O)[C@@H](NC(=O)C1CC(=O)N(C1)c1ccc2c(c1)OCCO2)C

STK583157
Synonyms: 9a- [(E)- 2- {3- ethoxy- 4- [(4- methylbenzyl)oxy]phenyl}ethenyl]- 9,9- dimethyl- 9,9a- dihydro- 1H- imidazo[1,2- a]indol- 2(3H)- one
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)C)/C=C/C12NC(=O)CN1c1c(C2(C)C)cccc1

STK583158
Synonyms: 3- benzyl- 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)Cc1ccccc1

STK583160
Synonyms: (4E)- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]- 5- [4- (prop- 2- en- 1- yloxy)phenyl]- 1- (1,3- thiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: C=CCOc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1nccs1

STK583162
Synonyms: 7- fluoro- 1- phenyl- 2- (2- phenylethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Fc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccccc1)CCc1ccccc1

STK583163
Synonyms: (3a'S,6a'R)- 5'- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 7- ethyl- 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: CCc1cccc2c1NC(=O)C12NC([C@@H]2[C@H]1C(=O)N(C2=O)c1ccc2c(c1)OCCO2)Cc1c[nH]c2c1cccc2

STK583164
Synonyms: 1- (3,4- dichlorophenyl)- 2- {[4- phenyl- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}ethanone
Smiles: O=C(c1ccc(c(c1)Cl)Cl)CSc1nnc(n1c1ccccc1)c1ccccn1

STK583167
Synonyms: methylN- [(2- phenylethyl)carbamoyl]- L- alaninate
Smiles: COC(=O)[C@@H](NC(=O)NCCc1ccccc1)C

STK583168
Synonyms: 8- [4- (2- chloro- 6- fluorobenzyl)piperazin- 1- yl]- 7- ethyl- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1c(F)cccc1Cl

STK583169
Synonyms: 3- (1H- benzimidazol- 2- yl)- N- benzylpropanamide
Smiles: O=C(CCc1nc2c([nH]1)cccc2)NCc1ccccc1

STK583171
Synonyms: N- [N- (4- chlorophenyl)- N'- (4,6- dimethylpyrimidin- 2- yl)carbamimidoyl]- 10H- phenothiazine- 10- carboxamide
Smiles: Clc1ccc(cc1)N/C(=N\c1nc(C)cc(n1)C)/NC(=O)N1c2ccccc2Sc2c1cccc2

STK583173
Synonyms: [4- ({(2'S,3S,3'S,10b'R)- 3'- [(4- fluorophenyl)carbonyl]- 2- oxo- 1,2,2',3'- tetrahydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2'- yl}carbonyl)phenoxy]acetonitrile
Smiles: N#CCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)F)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK583175
Synonyms: 5- (2- methylpropyl)- N- [3- (morpholin- 4- yl)propyl]- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinolin- 8- amine
Smiles: CC(Cc1nc2oc3c(c2c2c1CCCC2)ncnc3NCCCN1CCOCC1)C

STK583176
Synonyms: 4- chloro- N- (4- methoxyphenyl)- N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzenesulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)Cl)Cc1cc2cccc(c2[nH]c1=O)C

STK583177
Synonyms: (3S,3a'R,8a'S,8b'S)- 7- chloro- 2'- (2,3- 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: O=C1N(c2cccc(c2Cl)Cl)C(=O)[C@@H]2[C@H]1[C@@H]1CCCN1[C@]12C(=O)Nc2c1cccc2Cl

STK583178
Synonyms: (4- tert- butylphenyl)(6,7- dimethoxy- 1- methylidene- 3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: COc1cc2c(cc1OC)CCN(C2=C)C(=O)c1ccc(cc1)C(C)(C)C

STK583179
Synonyms: 1'- butyl- 6- hydroxy- 6'- nitro- 3- (2- phenylethyl)- 2'- propyl- 1',4'- dihydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinoline]- 2,4(3H)- dione
Smiles: CCCCN1c2ccc(cc2CC2(C1CCC)C(=NC(=O)N(C2=O)CCc1ccccc1)O)[N+](=O)[O-]

STK583182
Synonyms: 5- (2- fluorophenyl)- 4- {[(E)- (3- methylthiophen- 2- yl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccccc1c1n[nH]c(=S)n1/N=C/c1sccc1C

STK583183
Synonyms: 2- {[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,4- dimethoxyphenyl)acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CSc1nnc(n1C)c1cccc(c1)Cl

STK583184
Synonyms: N- (2- tert- butylphenyl)- 2- {[5- (2- fluorophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1C(C)(C)C)CSc1nnc(n1c1ccccc1)c1ccccc1F

STK583186
Synonyms: N- (4- chlorobenzyl)- 2- (6- oxo- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 7(6H)- yl)acetamide
Smiles: O=C(Cn1c2ccccc2c2c1c(=O)n1CCCSc1n2)NCc1ccc(cc1)Cl

STK583187
Synonyms: 2- [(3a'S,6a'R)- 5- bromo- 5'- 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: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1cc(Br)cc2

STK583188
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(2,4- dimethoxyphenyl)carbonyl]- 2'- (pyridin- 2- ylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1ccc(c(c1)OC)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccn1)C(=O)Nc1c2cccc1)cccc3

STK583189
Synonyms: 2- benzyl- 7- fluoro- 1- (pyridin- 4- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Fc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccncc1)Cc1ccccc1

STK583191
Synonyms: 5- (2- fluorophenyl)- 4- ({(E)- [4- (trifluoromethyl)phenyl]methylidene}amino)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(F)(F)F

STK583192
Synonyms: 7- (2,4- dichlorophenyl)- 8- (2,5- dimethylphenyl)- 1,3- dimethyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: Clc1ccc(c(c1)Cl)c1cn2c(n1c1cc(C)ccc1C)nc1c2c(=O)n(C)c(=O)n1C

STK583193
Synonyms: 6- butyl- 1- (2,3- dimethylphenyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: CCCCN1CNc2c(C1)c(=O)nc(n2c1cccc(c1C)C)S

STK583194
Synonyms: 8- (4- methoxyphenyl)- 9- (5- methyl- 1,2- oxazol- 3- yl)- 8,9- dihydrobenzo[7,8]chromeno[2,3- c]pyrrole- 7,10- dione
Smiles: COc1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c2ccccc2cc1

STK583195
Synonyms: N- [(3Z)- 8- methyl- 1- propyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 4- nitrobenzenesulfonamide
Smiles: CCCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])/c2c1nc1c(C)cccc1c2

STK583196
Synonyms: 8- methoxy- 5- methyl- 3- [3- (morpholin- 4- yl)propyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1n2C)CCCN1CCOCC1

STK583197
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- sulfamoylphenyl)acetamide
Smiles: COc1cccc(c1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(cc1)S(=O)(=O)N

STK583198
Synonyms: (5E)- 3- (4- chlorophenyl)- 6- hydroxy- 5- [5- (4- methoxyphenyl)pyrazolidin- 3- ylidene]pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1)C1NN/C(=C/2\C(=NC(=O)N(C2=O)c2ccc(cc2)Cl)O)/C1

STK583199
Synonyms: 2- (1H- benzimidazol- 2- ylsulfanyl)- N- (3- ethoxyphenyl)acetamide
Smiles: CCOc1cccc(c1)NC(=O)CSc1nc2c([nH]1)cccc2

STK583202
Synonyms: (6E)- 4- (1- benzofuran- 2- yl)- 6- [(3,4- dimethylphenyl)imino]- 1,6- dihydro- 1,3,5- triazin- 2- amine
Smiles: Nc1[nH]/c(=N\c2ccc(c(c2)C)C)/nc(n1)c1cc2c(o1)cccc2

STK583203
Synonyms: 1- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)- 2- [4- (phenylsulfonyl)piperazin- 1- yl]ethanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)CN1CCN(CC1)S(=O)(=O)c1ccccc1

STK583204
Synonyms: 8- (4- methoxyphenyl)- 1- methyl- 3- (2- methylpropyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: COc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CC(C)C

STK583206
Synonyms: 2- (3- ethoxy- 4- methoxyphenyl)- 4- imino- 6,7- dihydro- 4H- [1,3]dioxolo[4,5- g]pyrido[2,1- a]isoquinoline- 3- carbonitrile
Smiles: CCOc1cc(ccc1OC)c1cc2c3cc4OCOc4cc3CCn2c(=N)c1C#N

STK583207
Synonyms: 8- chloro- N,N- diethyl[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: CCN(c1ncnc2c1oc1c2cc(cc1)Cl)CC

STK583209
Synonyms: N- (3,4- dichlorophenyl)- 2- (4- oxoquinazolin- 3(4H)- yl)butanamide
Smiles: CCC(n1cnc2c(c1=O)cccc2)C(=O)Nc1ccc(c(c1)Cl)Cl

STK583210
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- [3- ethoxy- 4- (pentyloxy)phenyl]- 1- {5- [(2- fluorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}pyrrolidine- 2,3- dione
Smiles: CCCCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccccc1F

STK583211
Synonyms: ethyl4- [1- methyl- 3- (2- methylpropyl)- 2,4- dioxo- 1,2,3,4,7,8- hexahydropyrimido[2,1- f]purin- 9(6H)- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CC(C)C

STK583212
Synonyms: N- [(2Z)- 5- [(4- fluorobenzyl)sulfonyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- propoxybenzamide
Smiles: CCCOc1ccccc1C(=O)/N=c\1/[nH]nc(s1)S(=O)(=O)Cc1ccc(cc1)F

STK583213
Synonyms: (5E)- 5- (1,3- benzodioxol- 5- ylmethylidene)- 2- (2,4- dichlorophenyl)- 3- methyl- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: Clc1ccc(c(c1)Cl)C1=N/C(=C/c2ccc3c(c2)OCO3)/C(=O)N1C

STK583214
Synonyms: 4- bromo- N'- {4- [(5Z)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoyl}benzohydrazide
Smiles: O=C(NNC(=O)c1ccc(cc1)Br)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

STK583215
Synonyms: 1- (2,4- dinitrophenyl)- 2- [4- (2- methylpentan- 2- yl)cyclohexylidene]hydrazine
Smiles: CCCC(C1CC/C(=N/Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])/CC1)(C)C

STK583217
Synonyms: 1- methyl- 3- (3- methylbutyl)- 8- (4- methylphenyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CC(CCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccc(cc1)C)C

STK583218
Synonyms: (4E)- 1- (furan- 2- ylmethyl)- 4- [hydroxy(3- nitrophenyl)methylidene]- 5- [4- (propan- 2- yl)phenyl]pyrrolidine- 2,3- dione
Smiles: CC(c1ccc(cc1)C1/C(=C(/c2cccc(c2)[N+](=O)[O-])\O)/C(=O)C(=O)N1Cc1ccco1)C

STK583219
Synonyms: propan- 2- yl{[3- cyano- 4- phenyl- 6- (thiophen- 2- yl)pyridin- 2- yl]sulfanyl}acetate
Smiles: N#Cc1c(SCC(=O)OC(C)C)nc(cc1c1ccccc1)c1cccs1

STK583220
Synonyms: N- (3- chloro- 4- fluorophenyl)- 2- {[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)F)CSc1nnc(n1C)c1cccc(c1)Cl

STK583225
Synonyms: (5s,7s)- 5- ethyl- 7- methyl- 2- [4- (prop- 2- en- 1- yloxy)phenyl]- 1,3- diazatricyclo[3.3.1.1~3,7~]decan- 6- one
Smiles: C=CCOc1ccc(cc1)C1N2C[C@@]3(CN1C[C@](C2)(C3=O)CC)C

STK583227
Synonyms: 3- (2- chlorophenyl)- 4- (4- chlorophenyl)- 5- [(2- fluorobenzyl)sulfanyl]- 4H- 1,2,4- triazole
Smiles: Clc1ccc(cc1)n1c(SCc2ccccc2F)nnc1c1ccccc1Cl

STK583231
Synonyms: 4- (4- chlorophenyl)- 6- (4- methoxyphenyl)- 2- methylpyridazino[3',4':4,5]pyrimido[1,6- a]benzimidazol- 1(4H)- one
Smiles: COc1ccc(cc1)c1nc2n(nc(c(=O)c2c2n1c1ccccc1n2)C)c1ccc(cc1)Cl

STK583232
Synonyms: 4- {[(E)- anthracen- 9- ylmethylidene]amino}- 5- (pyridin- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1/N=C/c1c2ccccc2cc2c1cccc2)c1ccccn1

STK583234
Synonyms: 2- methyl- 7- [(2- methylprop- 2- en- 1- yl)sulfanyl]- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidine
Smiles: CC(=C)CSc1nnc2n1c1sc3c(c1c1n2nc(n1)C)CCCC3

STK583235
Synonyms: 7- chloro- 2- (pyridin- 3- ylmethyl)- 1- (3,4,5- trimethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cc(cc(c1OC)OC)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK583236
Synonyms: methyl(2E)- 2- ({[(3,4- dimethoxyphenyl)carbonyl]carbamothioyl}imino)- 4- methyl- 2,3- dihydro- 1,3- thiazole- 5- carboxylate
Smiles: COC(=O)c1s/c(=N/C(=S)NC(=O)c2ccc(c(c2)OC)OC)/[nH]c1C

STK583237
Synonyms: 6- (3- chlorobenzyl)- 5- methyl- 2- propyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCCc1nn2c(n1)nc(c(c2O)Cc1cccc(c1)Cl)C

STK583239
Synonyms: 2- {[4- (4- methylphenyl)- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [2- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1

STK583241
Synonyms: (3a'S,6a'R)- 3'- (1H- indol- 3- ylmethyl)- 5'- (3- nitrophenyl)- 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(c2cccc(c2)[N+](=O)[O-])C(=O)[C@@H]2[C@H]1C(Cc1c[nH]c3c1cccc3)NC12C(=O)Nc2c1cccc2

STK583243
Synonyms: 8- chloro- 2- methyl- N- (3- methylphenyl)[1]benzofuro[3,2- d]pyrimidin- 4- amine
Smiles: Clc1ccc2c(c1)c1nc(C)nc(c1o2)Nc1cccc(c1)C

STK583244
Synonyms: 3- (4- chlorophenyl)- 8- [(4- ethylpiperazin- 1- yl)methyl]- 7- hydroxy- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CCN1CCN(CC1)Cc1c(O)ccc2c1oc(c(c2=O)c1ccc(cc1)Cl)C(F)(F)F

STK583245
Synonyms: 3- cyclopentyl- 10- methyl- 2- (4- methylphenyl)pyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: Cc1ccc(cc1)c1nc2c(c(=O)n1C1CCCC1)c(=O)c1c(n2C)cccc1

STK583246
Synonyms: 2- (5,10,10- trimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)benzoicacid
Smiles: OC(=O)c1ccccc1c1nn2c(n1)c1c(nc2C)sc2c1CC(C)(C)OC2

STK583247
Synonyms: 2,6- dibenzyl- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Cc1nc2nc(nn2c(c1Cc1ccccc1)O)Cc1ccccc1

STK583248
Synonyms: (4E)- 6- {[4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]methyl}- 4- [(4- methylphenyl)imino]- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: Cc1ccc(cc1)/N=c/1\[nH]c(CN2CCN(CC2)Cc2ccc3c(c2)OCO3)nc(n1)N

STK583249
Synonyms: N- (2- methoxyethyl)- 10- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: COCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CC(C)CC2

STK583250
Synonyms: 2- {[5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]sulfanyl}- N- (4- chlorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nnc(s1)SCc1ccccc1

STK583252
Synonyms: N- [6- chloro- 3- (naphthalen- 1- yl)- 4- oxo- 4H- chromen- 2- yl]- 4- methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1oc2ccc(cc2c(=O)c1c1cccc2c1cccc2)Cl

STK583255
Synonyms: (4E)- 1- (4- ethoxyphenyl)- 4- [(2E)- 1- hydroxy- 3- phenylprop- 2- en- 1- ylidene]- 5- phenylpyrrolidine- 2,3- dione
Smiles: CCOc1ccc(cc1)N1C(=O)C(=O)/C(=C(\C=C\c2ccccc2)/O)/C1c1ccccc1

STK583262
Synonyms: 8- (4- ethylpiperazin- 1- yl)- 2,2- dimethyl- 5- (2- methylpropyl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: CCN1CCN(CC1)c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)CC(C)C

STK583263
Synonyms: (4E)- 2- (2,4- dimethoxyphenyl)- 4- {[(4- methoxyphenyl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc(cc1)N/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(cc1OC)OC

STK583264
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 1- (5- methyl- 1,3,4- thiadiazol- 2- yl)- 5- (4- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: Cc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccc(cc1)[N+](=O)[O-]

STK583265
Synonyms: N- (5- chloro- 2- methylphenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)ccc1C)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK583266
Synonyms: (3R,3'S,5'S)- N- (2,5- dimethoxyphenyl)- 7- methyl- 5'- (2- methylpropyl)- 2- oxo- 1,2- dihydrospiro[indole- 3,2'- pyrrolidine]- 3'- carboxamide
Smiles: COc1ccc(c(c1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cccc1C)CC(C)C)OC

STK583267
Synonyms: (5E)- 1- (3- chlorophenyl)- 5- [(morpholin- 4- ylamino)methylidene]- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: Clc1cccc(c1)N1C(=NC(=O)/C(=C\NN2CCOCC2)/C1=O)S

STK583268
Synonyms: N,N- dimethyl- 4- (5- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)aniline
Smiles: CN(c1ccc(cc1)c1nn2c(n1)c1c(nc2C)sc2c1CCCC2)C

STK583269
Synonyms: (2S)- N- (2- fluorophenyl)- 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanamide
Smiles: Fc1ccccc1NC(=O)[C@@H](n1nnc2c(c1=O)cccc2)C

STK583270
Synonyms: 1- benzyl- N- [(2E)- 6- bromo- 1,3- benzothiazol- 2(3H)- ylidene]- 4- hydroxy- 2- oxo- 1,2- dihydroquinoline- 3- carboxamide
Smiles: Brc1ccc2c(c1)s/c(=N/C(=O)c1c(O)c3ccccc3n(c1=O)Cc1ccccc1)/[nH]2

STK583273
Synonyms: 3- [(4- methylpyridin- 2- yl)amino]- 2- benzofuran- 1(3H)- one
Smiles: Cc1ccnc(c1)NC1OC(=O)c2c1cccc2

STK583274
Synonyms: (4Z)- 6- [(4- benzylpiperazin- 1- yl)methyl]- 4- [(2- methoxyphenyl)imino]- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: COc1ccccc1/N=c/1\nc(N)nc([nH]1)CN1CCN(CC1)Cc1ccccc1

STK583276
Synonyms: 2- ({4- amino- 5- [5- (4- methylphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (5- chloropyridin- 2- yl)acetamide
Smiles: O=C(Nc1ccc(cn1)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK583278
Synonyms: N- [7- (4- chlorophenyl)- 5- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]furan- 2- carboxamide
Smiles: Clc1ccc(cc1)C1C=C(N=c2n1nc([nH]2)NC(=O)c1ccco1)c1ccccc1

STK583280
Synonyms: N'- {(Z)- [4,6- dioxo- 1- (prop- 2- en- 1- yl)- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}heptanehydrazide
Smiles: CCCCCCC(=O)NN/C=C\1/C(=O)N=C(N(C1=O)CC=C)S

STK583282
Synonyms: 2- {[4- amino- 5- (2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (2- chloro- 10H- phenothiazin- 10- yl)ethanone
Smiles: Clc1ccc2c(c1)N(C(=O)CSc1nnc(n1N)c1[nH]nc3c1CCC3)c1c(S2)cccc1

STK583283
Synonyms: 5- [(2E)- 3- (3,4- dimethoxyphenyl)prop- 2- enoyl]- 2,6- dihydroxy- 3- (prop- 2- en- 1- yl)pyrimidin- 4(3H)- one
Smiles: C=CCn1c(O)nc(c(c1=O)C(=O)/C=C/c1ccc(c(c1)OC)OC)O

STK583284
Synonyms: 2- methyl- N- [(8- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (3- methylphenyl)benzamide
Smiles: Cc1cccc(c1)N(C(=O)c1ccccc1C)Cc1cc2cccc(c2[nH]c1=O)C

STK583287
Synonyms: N- [4- (diethylamino)phenyl]- 5,6- dimethoxy- 1H- indole- 2- carboxamide
Smiles: CCN(c1ccc(cc1)NC(=O)c1cc2c([nH]1)cc(c(c2)OC)OC)CC

STK583289
Synonyms: 3- (3- bromophenyl)- 5- ethyl- 3H- pyrrolo[2',3':4,5]pyrimido[1,6- a]benzimidazol- 1- ylpropanoate
Smiles: CCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CC)cccc3)c1cccc(c1)Br

STK583290
Synonyms: 2- ethyl- 3- methyl- 1- [(2E)- 2- (quinolin- 4- ylmethylidene)hydrazinyl]pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: CCc1c(C)c(C#N)c2n(c1N/N=C/c1ccnc3c1cccc3)c1ccccc1n2

STK583291
Synonyms: methyl(1- {3- [(Z)- (3- butyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 7- methyl- 4- oxo- 4H- pyrido[1,2- a]pyrimidin- 2- yl}- 3- oxopiperazin- 2- yl)acetate
Smiles: CCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCNC(=O)C2CC(=O)OC)/C1=O

STK583292
Synonyms: 2- (benzylamino)- 8- methyl- 4- (4- methylphenyl)- 4,9- dihydro- 6H- pyrimido[1,2- a][1,3,5]triazin- 6- one
Smiles: Cc1ccc(cc1)C1N=C(NCc2ccccc2)N=c2n1c(=O)cc([nH]2)C

STK583293
Synonyms: N- [(2E)- 3- [2- (4- fluorophenyl)ethyl]- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- phenoxyacetamide
Smiles: O=C(/N=C\1/SC2C(N1CCc1ccc(cc1)F)CS(=O)(=O)C2)COc1ccccc1

STK583295
Synonyms: N,N- diethyl- 2- (10- fluoro- 6- oxo- 3,4- dihydro- 2H- [1,3]thiazino[3',2':1,2]pyrimido[5,4- b]indol- 7(6H)- yl)acetamide
Smiles: CCN(C(=O)Cn1c2ccc(cc2c2c1c(=O)n1CCCSc1n2)F)CC

STK583296
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(2,4- dichlorophenyl)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: CC(Cc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2Cl)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C

STK583299
Synonyms: N- [(2Z)- 5- [(4- chlorobenzyl)sulfonyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- propoxybenzamide
Smiles: CCCOc1ccccc1C(=O)/N=c\1/[nH]nc(s1)S(=O)(=O)Cc1ccc(cc1)Cl

STK583300
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK583301
Synonyms: (4E)- 2- (4- bromophenyl)- 4- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: Brc1ccc(cc1)N1C(=O)/C(=C/NCCCN2CCOCC2)/c2c(C1=O)cccc2

STK583302
Synonyms: 2,12,12- trimethyl- 7- [(3- methylbutyl)sulfanyl]- 12,13- dihydro- 10H- pyrano[4',3':4,5]thieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidine
Smiles: CC(CCSc1nnc2n1c1sc3c(c1c1n2nc(n1)C)CC(OC3)(C)C)C

STK583305
Synonyms: 6,6- dimethyl- 9- (3- methylphenyl)- 2- (methylsulfanyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CSc1nn2c(n1)N=C1C(=C(O)CC(C1)(C)C)C2c1cccc(c1)C