FULL DB

Total number of items: 1633432
Total number of pages: 1634 ( 1000 items on each page )

STK852578
Synonyms: N-[(2E)-6-(diprop-2-en-1-ylsulfamoyl)-1,3-benzothiazol-2(3H)-ylidene]-2-methylpropanamide
Smiles: C=CCN(S(=O)(=O)c1ccc2c(c1)s/c(=N/C(=O)C(C)C)/[nH]2)CC=C

STK852579
Synonyms: 2-(methoxymethyl)-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: COCc1nn2c(c1c1ccccc1)nc(cc2O)C

STK596726
Synonyms: 2-(2-cycloheptylidenehydrazinyl)-3-hydroxyquinazolin-4(3H)-one
Smiles: On1c(NN=C2CCCCCC2)nc2c(c1=O)cccc2

STK596727
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4'-carbamoyl-1,4'-bipiperidin-1'-yl)methyl]-1H-1,2,3-triazole-4-carboxylicacid
Smiles: NC(=O)C1(CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)O)N1CCCCC1

STK596730
Synonyms: 2-methyl-4-[2-(piperidin-1-yl)ethyl]-4H-[1,3]thiazolo[5,4-b]indole
Smiles: Cc1nc2c(s1)n(c1c2cccc1)CCN1CCCCC1

STK596731
Synonyms: 2-({5-[(1S)-1-amino-3-methylbutyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-N-(2,4-dimethylphenyl)acetamide
Smiles: CC(C[C@@H](c1nnc(o1)SCC(=O)Nc1ccc(cc1C)C)N)C

STK852580
Synonyms: N-(2-methoxyethyl)-8,10-dimethyl-2-propylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-4-amine
Smiles: CCCc1cc(NCCOC)n2c(n1)c1c(C)cc(nc1n2)C

STK596736
Synonyms: 6-chloro-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-ethoxybenzyl)-7-methyl-4-oxo-4H-chromene-2-carboxamide
Smiles: CCOc1ccc(cc1)CN(C(=O)c1cc(=O)c2c(o1)cc(c(c2)Cl)C)C1CCS(=O)(=O)C1

STK852581
Synonyms: 4-(4-fluorophenyl)-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1ccc(cc1)n1c(=S)[nH]nc1c1ccncc1

STK852582
Synonyms: N-(butan-2-yl)-2-methyl-3-phenyl-5-(propan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CCC(Nc1cc(nc2n1nc(c2c1ccccc1)C)C(C)C)C

STK596739
Synonyms: 9-(4-fluorophenyl)-4-hydroxy-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purin-2(1H)-one
Smiles: CC1CN(c2ccc(cc2)F)c2n(C1)c1c(O)nc(=O)n(c1n2)C

STK596745
Synonyms: (5Z)-5-[5-(1,3-benzodioxol-5-yl)-1-propanoylpyrazolidin-3-ylidene]-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCC(=O)N1N/C(=C\2/C(=O)NC(=O)N(C2=O)Cc2ccccc2)/CC1c1ccc2c(c1)OCO2

STK596746
Synonyms: N-[(4-acetylphenyl)carbamoyl]isoleucine
Smiles: CCC(C(C(=O)O)NC(=O)Nc1ccc(cc1)C(=O)C)C

STK596749
Synonyms: 2-[4-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-[(4-ethenylbenzyl)oxy]phenol
Smiles: C=Cc1ccc(cc1)COc1ccc(c(c1)O)c1n[nH]cc1c1ccc(cc1)Cl

STK596750
Synonyms: 3-(5-chloro-2-hydroxy-4-methylphenyl)-4-(4-ethylphenyl)-5-(pyridin-3-ylmethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: CCc1ccc(cc1)C1N(Cc2cccnc2)C(=O)c2c1c([nH]n2)c1cc(Cl)c(cc1O)C

STK596751
Synonyms: (5Z)-3-(morpholin-4-yl)-2-thioxo-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazolidin-4-one
Smiles: COc1cc(/C=C/2\SC(=S)N(C2=O)N2CCOCC2)cc(c1OC)OC

STK596756
Synonyms: 3-benzyl-2-ethyl-4H-thiochromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: CCc1nc2sc3ccccc3c(=O)c2c(=O)n1Cc1ccccc1

STK596758
Synonyms: 3-[(3a'S,6a'R)-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]propanoicacid
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CCC(=O)O)C(=O)Nc2c1cccc2

STK596759
Synonyms: 2-methyl-7-{4-[2-(naphthalen-1-yloxy)ethyl]piperazin-1-yl}-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine
Smiles: CCCc1cc(N2CCN(CC2)CCOc2cccc3c2cccc3)n2c(n1)c(c1ccccc1)c(n2)C

STK596761
Synonyms: 2-benzyl-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: Cc1cc(O)n2c(n1)c(c1ccccc1)c(n2)Cc1ccccc1

STK596779
Synonyms: 4-{4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl}-2,8,10-trimethylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidine
Smiles: Clc1ccc(cc1)OCCN1CCN(CC1)c1cc(C)nc2n1nc1c2c(C)cc(n1)C

STK852587
Synonyms: 3'-(4-methoxyphenyl)-2-(methylsulfonyl)-1',5-diphenyl-3,4-dihydro-1'H,2H-3,4'-bipyrazole
Smiles: COc1ccc(cc1)c1nn(cc1C1CC(=NN1S(=O)(=O)C)c1ccccc1)c1ccccc1

STK852589
Synonyms: 4-(1,3-benzodioxol-5-yl)-5-(thiophen-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1c1ccc2c(c1)OCO2)c1cccs1

STK596785
Synonyms: 5-(5-chloro-2-hydroxyphenyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1H-pyrazole-3-carboxamide
Smiles: Clc1ccc(c(c1)c1[nH]nc(c1)C(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C)O

STK596787
Synonyms: (5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{4-[(4-fluorobenzyl)oxy]benzylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(C)/C(=C/c2ccc(cc2)OCc2ccc(cc2)F)/C(=O)N(C1=O)C1CCS(=O)(=O)C1

STK852590
Synonyms: ethyl4-[3-(1H-benzimidazol-2-yl)propanoyl]piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)CCc1nc2c([nH]1)cccc2

STK852591
Synonyms: N,N-diethyl-1-(3-methoxypropyl)-9-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)N(CC)CC

STK596789
Synonyms: 4-({3-[(5E)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]propanoyl}amino)-2-hydroxybenzoicacid
Smiles: O=C(Nc1ccc(c(c1)O)C(=O)O)CCN1C(=O)S/C(=C/c2ccccc2)/C1=O

STK596790
Synonyms: 1-(4-fluorophenyl)-4-(furan-2-yl)-6-hydroxy-3-methyl-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
Smiles: N#Cc1c(O)nc2c(c1c1ccco1)c(C)nn2c1ccc(cc1)F

STK596796
Synonyms: 6-amino-2-(4-phenylpiperazin-1-yl)pyrimidin-4-ol
Smiles: Nc1cc(O)nc(n1)N1CCN(CC1)c1ccccc1

STK596798
Synonyms: (3-ethoxy-3-oxopropyl)[hydroxy(diphenyl)methyl]phosphinicacid
Smiles: CCOC(=O)CCP(=O)(C(c1ccccc1)(c1ccccc1)O)O

STK596801
Synonyms: (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-({[4-(dimethylamino)phenyl]amino}methylidene)-2-hydroxypyrimidine-4,6(1H,5H)-dione
Smiles: CN(c1ccc(cc1)N/C=C\1/C(=O)N=C(N(C1=O)CCC1=CCCCC1)O)C

STK596806
Synonyms: (3S)-N-{2-[(4-methylphenyl)amino]-2-oxoethyl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: O=C(Nc1ccc(cc1)C)CNC(=O)[C@H]1NCc2c(C1)cccc2

STK596808
Synonyms: 1',3,3',9-tetramethyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[benzo[g]pyrido[1,2-a][1,8]naphthyridine-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: CC1CCN2C(C1)C1(Cc3c2nc2ccc(cc2c3)C)C(=O)N(C)C(=O)N(C1=O)C

STK596811
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,N-diethylacetamide
Smiles: CCN(C(=O)CSc1nnc2n1c(Nc1ccc(cc1)C)c(C#N)c1c2COC(C1)(C)C)CC

STK596813
Synonyms: 5-[(2-chloro-6-fluorobenzyl)oxy]-2-[4-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]phenol
Smiles: Clc1ccc(cc1)c1c([nH]nc1C(F)(F)F)c1ccc(cc1O)OCc1c(F)cccc1Cl

STK596817
Synonyms: 2-[(5Z)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]-N-methylacetamide
Smiles: O=C(N(CC(=O)c1ccc(c(c1)O)O)C)CN1C(=S)S/C(=C\c2ccccc2)/C1=O

STK852596
Synonyms: 1-methyl-6,7-dihydro[1,3]thiazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: O=c1[nH]c(=O)n(c2c1n1CCSc1n2)C

STK596824
Synonyms: N-[(2-hydroxyquinolin-4-yl)methyl]-N-propylpropanamide
Smiles: CCCN(C(=O)CC)Cc1cc(O)nc2c1cccc2

STK596830
Synonyms: 1-tert-butyl4-(8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)piperidine-1,4-dicarboxylate
Smiles: COc1ccc2c(c1)c(=O)oc1c2ccc(c1C)OC(=O)C1CCN(CC1)C(=O)OC(C)(C)C

STK596831
Synonyms: 4-chloro-N-[2-(furan-2-yl)-5-hydroxy[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1cc(O)nc2n1nc(n2)c1ccco1

STK852600
Synonyms: 1-benzyl-N,9-dimethyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: CNC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C

STK852601
Synonyms: (2Z)-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl4-methoxybenzenesulfonate
Smiles: COc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1cccnc1)/C2=O

STK596835
Synonyms: 1-(2-phenylethyl)-6-propyl-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CCCN1CNc2c(C1)c(=O)nc(n2CCc1ccccc1)S

STK596839
Synonyms: (2Z)-1-(3,5-dichlorophenyl)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)ethanone
Smiles: Clc1cc(Cl)cc(c1)C(=O)/C=C/1\NCCc2c1cc1OCOc1c2

STK596841
Synonyms: ethyl2-amino-4-(2,5-dichlorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C1c1cc(Cl)ccc1Cl)oc(cc2=O)CO

STK596843
Synonyms: 2-[(4-chlorobenzyl)amino]-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(3H)-one
Smiles: CCCc1cc(=O)n2c(n1)[nH]c(n2)NCc1ccc(cc1)Cl

STK596844
Synonyms: 3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-(4-methoxyphenyl)propanamide
Smiles: COc1ccc(cc1)NC(=O)CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK596845
Synonyms: 2-(2-methylphenyl)-12-(pyridin-3-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
Smiles: Oc1ccc2c(c1)Oc1c(C2c2cccnc2)c2nc(nn2cn1)c1ccccc1C

STK596850
Synonyms: 1-amino-2-[(2-hydroxyethyl)amino]-4-(phenylamino)anthracene-9,10-dione
Smiles: OCCNc1cc(Nc2ccccc2)c2c(c1N)C(=O)c1c(C2=O)cccc1

STK596856
Synonyms: 2-(1,3-benzoxazol-2-ylamino)-4-(2-methoxyphenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinazolin-5-ol
Smiles: COc1ccccc1C1N=C(Nc2nc3c(o2)cccc3)N=C2C1=C(O)CC(C2)(C)C

STK852605
Synonyms: 2-[2-amino-5-(3-methoxyphenoxy)-6-methylpyrimidin-4-yl]-5-[(4-methylbenzyl)oxy]phenol
Smiles: COc1cccc(c1)Oc1c(C)nc(nc1c1ccc(cc1O)OCc1ccc(cc1)C)N

STK596859
Synonyms: 3-(1H-benzimidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CCn1cnc2c1cccc2

STK596860
Synonyms: N-[(1Z)-1-{1-cyano-2-[(3-methylbutyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]thiophene-2-carboxamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1cccs1)/C(=O)NCCC(C)C

STK596861
Synonyms: 5-methoxy-3-methyl-N-(quinolin-3-yl)-1H-indole-2-carboxamide
Smiles: COc1ccc2c(c1)c(C)c([nH]2)C(=O)Nc1cnc2c(c1)cccc2

STK596862
Synonyms: 7-fluoro-1-[3-(3-methylbutoxy)phenyl]-2-(6-methylpyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CC(CCOc1cccc(c1)C1N(c2cccc(n2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F)C

STK596865
Synonyms: N-[4-(furan-2-yl)butan-2-yl]-6-methoxy-N-methyl-1H-indole-2-carboxamide
Smiles: COc1ccc2c(c1)[nH]c(c2)C(=O)N(C(CCc1ccco1)C)C

STK596866
Synonyms: (5Z)-5-[(2E)-3-phenylprop-2-en-1-ylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: O=c1/c(=C/C=C/c2ccccc2)/sc2n1ncn2

STK596869
Synonyms: (3a'S,6a'R)-5'-tert-butyl-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CC(C1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cccc1)C

STK596876
Synonyms: 5,7-dihydroxy-2-(methylamino)thieno[3,2-b]pyridine-3-carbonitrile
Smiles: N#Cc1c(NC)sc2c1nc(O)cc2O

STK596877
Synonyms: 7-(2-chlorophenyl)-3-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Clc1ccccc1n1ncc2c1ncn1c2nnc1c1ccccc1

STK596878
Synonyms: 2-(benzylsulfanyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Cc1cc(O)n2c(n1)nc(n2)SCc1ccccc1

STK596880
Synonyms: 2-[(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl]-5-phenylthieno[2,3-d]pyrimidin-4(3H)-one
Smiles: COc1cc2c(cc1OC)CCN(C2C)Cc1nc2scc(c2c(=O)[nH]1)c1ccccc1

STK596881
Synonyms: methylN-[(2,3-dichlorophenyl)carbamoyl]-L-leucinate
Smiles: COC(=O)[C@@H](NC(=O)Nc1cccc(c1Cl)Cl)CC(C)C

STK596882
Synonyms: 4-(4-bromophenyl)-2,6-dimethylpyridazino[3',4':4,5]pyrimido[1,6-a]benzimidazol-1(4H)-one
Smiles: Brc1ccc(cc1)n1nc(C)c(=O)c2c1nc(C)n1c2nc2c1cccc2

STK852609
Synonyms: 5-(benzyloxy)-2-[5-(2-methoxyphenoxy)pyrimidin-4-yl]phenol
Smiles: COc1ccccc1Oc1cncnc1c1ccc(cc1O)OCc1ccccc1

STK596883
Synonyms: N-(3-chlorophenyl)-2,4-dihydroxy-6,7-dimethoxyquinoline-3-carboxamide
Smiles: COc1cc2nc(O)c(c(c2cc1OC)O)C(=O)Nc1cccc(c1)Cl

STK852614
Synonyms: 1-(3-chlorophenyl)-2-(2-methoxyethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COCCN1C(=O)c2c(C1c1cccc(c1)Cl)c(=O)c1c(o2)cccc1

STK596885
Synonyms: (5Z)-3-(3-chlorophenyl)-2-hydroxy-5-[(2-methyl-1H-indol-3-yl)methylidene]-3,5-dihydro-4H-imidazol-4-one
Smiles: Clc1cccc(c1)N1C(=N/C(=C\c2c(C)[nH]c3c2cccc3)/C1=O)O

STK596888
Synonyms: 4-(3,4-dichlorophenyl)-3-(2-hydroxy-3,5-dimethylphenyl)-5-(2-hydroxyethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: OCCN1C(=O)c2c(C1c1ccc(c(c1)Cl)Cl)c([nH]n2)c1cc(C)cc(c1O)C

STK852617
Synonyms: 2-[(2,4-dimethylphenyl)amino]-8-methyl-4-phenyl-4,9-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Smiles: Cc1ccc(c(c1)C)NC1=NC(c2ccccc2)n2c(=N1)[nH]c(cc2=O)C

STK596892
Synonyms: 2-(3-methoxyphenyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1cccc(c1)c1nn2c(n1)c1c(nc2)sc2c1CCCC2

STK596900
Synonyms: 2,2-dimethyl-8-(4-methylpiperazin-1-yl)-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: CC(Cc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3N1CCN(CC1)C)C

STK852619
Synonyms: (2E)-3-(1,3-benzodioxol-5-yl)-N-[(2Z)-6-(methylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]prop-2-enamide
Smiles: O=C(/N=c/1\sc2c([nH]1)ccc(c2)S(=O)(=O)C)/C=C/c1ccc2c(c1)OCO2

STK852620
Synonyms: 6-methyl-4-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-4H-chromene-2-carboxamide
Smiles: Cc1ccc2c(c1)c(=O)cc(o2)C(=O)NCCc1ccc(cc1)S(=O)(=O)N

STK596902
Synonyms: 4-{[3-(2,3-dihydro-1,4-benzodioxin-2-yl)propanoyl]amino}benzoicacid
Smiles: O=C(Nc1ccc(cc1)C(=O)O)CCC1COc2c(O1)cccc2

STK596903
Synonyms: 6-chloro-1-hydroxy-9-oxo-9H-xanthen-3-ylN-(tert-butoxycarbonyl)-D-alaninate
Smiles: O=C(OC(C)(C)C)N[C@@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)ccc(c1)Cl)C

STK596906
Synonyms: (2Z)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)-N-(1-methoxypropan-2-yl)ethanethioamide
Smiles: COCC(NC(=S)/C=C/1\NCCc2c1cc(OC)c(c2)OC)C

STK596914
Synonyms: 7-hydrazinyl-2,5-dimethyl-3-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine
Smiles: NNc1cc(C)nc2n1nc(c2c1ccc(cc1)C)C

STK596915
Synonyms: 3,4-dimethoxy-N-[(2-{[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]carbonyl}hydrazinyl)carbonothioyl]benzamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)C(=O)NNC(=S)NC(=O)c1ccc(c(c1)OC)OC

STK596916
Synonyms: 3-(2-methoxyethyl)-2-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: COCCn1c(nc2c(c1=O)c(=O)c1c(o2)cccc1)C(C)C

STK596917
Synonyms: 5,6-dimethyl-N-[2-(morpholin-4-yl)ethyl]-7-(pyridin-3-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Smiles: Cc1c(C)n(c2c1c(NCCN1CCOCC1)ncn2)c1cccnc1

STK852622
Synonyms: (2Z)-2-(4-ethoxybenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one
Smiles: CCOc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)C

STK596921
Synonyms: 4-[({4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexyl}carbonyl)amino]butanoicacid
Smiles: OC(=O)CCCNC(=O)C1CCC(CC1)Cn1cnc2c(c1=O)cccc2

STK596923
Synonyms: 1-[10-(furan-2-yl)-8-methyl-2-(pyridin-3-yl)-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
Smiles: CC(=O)C1=C(C)Oc2c(C1c1ccco1)c1nc(nn1cn2)c1cccnc1

STK852623
Synonyms: 3-(4-methoxyphenyl)-2-methyl-4-oxo-4H-chromen-7-yldiethylcarbamate
Smiles: CCN(C(=O)Oc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)OC)C)CC

STK852624
Synonyms: 2-[2-amino-5-(4-methoxyphenyl)-6-methylpyrimidin-4-yl]-5-[(4-fluorobenzyl)oxy]phenol
Smiles: COc1ccc(cc1)c1c(C)nc(nc1c1ccc(cc1O)OCc1ccc(cc1)F)N

STK596928
Synonyms: 5-tert-butyl-7-[4-(5-chloro-2-methoxybenzyl)piperazin-1-yl]-3-phenylpyrazolo[1,5-a]pyrimidine
Smiles: COc1ccc(cc1CN1CCN(CC1)c1cc(nc2n1ncc2c1ccccc1)C(C)(C)C)Cl

STK852625
Synonyms: 2-[4-(2-methoxyphenyl)-1,2-oxazol-5-yl]-5-[(2-methylprop-2-en-1-yl)oxy]phenol
Smiles: COc1ccccc1c1cnoc1c1ccc(cc1O)OCC(=C)C

STK852626
Synonyms: 2,8,10-trimethyl-N-phenylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-4-amine
Smiles: Cc1cc(Nc2ccccc2)n2c(n1)c1c(C)cc(nc1n2)C

STK596943
Synonyms: 5-tert-butyl-3-(4-methylphenyl)-7-(piperidin-1-yl)pyrazolo[1,5-a]pyrimidine
Smiles: Cc1ccc(cc1)c1cnn2c1nc(cc2N1CCCCC1)C(C)(C)C

STK596944
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-5,6-di(furan-2-yl)furo[2,3-d]pyrimidin-4-amine
Smiles: COc1cc(CCNc2ncnc3c2c(c2ccco2)c(o3)c2ccco2)ccc1OC

STK596948
Synonyms: 1-(2,3-dimethylphenyl)-3-(4-hydroxy-6-methylpyrimidin-2-yl)guanidine
Smiles: N=C(Nc1cccc(c1C)C)Nc1nc(C)cc(n1)O

STK596954
Synonyms: N-(2-chlorophenyl)-2-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)acetamide
Smiles: COc1cc2c(cc1OC)CCN(C2C)CC(=O)Nc1ccccc1Cl

STK596961
Synonyms: 3-(1H-benzimidazol-2-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-one
Smiles: COc1ccccc1N1CCN(CC1)C(=O)CCc1nc2c([nH]1)cccc2

STK596968
Synonyms: 4-(3,4-dimethoxyphenyl)-3-(2-hydroxy-3,5-dimethylphenyl)-5-(pyridin-3-ylmethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1ccc(cc1OC)C1N(Cc2cccnc2)C(=O)c2c1c([nH]n2)c1cc(C)cc(c1O)C

STK596971
Synonyms: 2-benzyl-9,9-dimethyl-12-(pyridin-3-yl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Smiles: O=C1CC(C)(C)CC2=C1C(c1cccnc1)c1c(O2)ncn2c1nc(n2)Cc1ccccc1

STK852628
Synonyms: {[3-(2,5-dimethoxyphenyl)-4-methyl-2-oxo-2H-chromen-6-yl]oxy}acetonitrile
Smiles: N#CCOc1ccc2c(c1)c(C)c(c(=O)o2)c1cc(OC)ccc1OC

STK852629
Synonyms: 2-ethoxy-N-[(4Z)-2-(4-nitrophenyl)quinazolin-4(3H)-ylidene]aniline
Smiles: CCOc1ccccc1/N=c/1\[nH]c(nc2c1cccc2)c1ccc(cc1)[N+](=O)[O-]

STK596978
Synonyms: 2-[(6-chloro-2-oxo-4-propyl-2H-chromen-7-yl)oxy]-N-(pyridin-3-ylmethyl)acetamide
Smiles: CCCc1cc(=O)oc2c1cc(Cl)c(c2)OCC(=O)NCc1cccnc1

STK596979
Synonyms: 5-[(3,4-dichlorobenzyl)oxy]-2-[4-(2-methoxyphenyl)-1,2-oxazol-5-yl]phenol
Smiles: COc1ccccc1c1cnoc1c1ccc(cc1O)OCc1ccc(c(c1)Cl)Cl

STK852631
Synonyms: 1,3,6,7-tetramethyl-8-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc1n2c(c(n1c1ccccc1)C)C

STK596981
Synonyms: (5E)-6-hydroxy-5-(1-{[2-(piperazin-1-yl)ethyl]amino}propylidene)-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: C=CCN1C(=O)N=C(/C(=C(\NCCN2CCNCC2)/CC)/C1=O)O

STK596991
Synonyms: 4-{[(1-ethyl-1H-benzimidazol-2-yl)methyl]amino}benzenesulfonamide
Smiles: CCn1c(CNc2ccc(cc2)S(=O)(=O)N)nc2c1cccc2

STK596992
Synonyms: (5E)-3-(3-chlorophenyl)-5-{[2,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-3-yl]methylidene}-2-hydroxy-3,5-dihydro-4H-imidazol-4-one
Smiles: Clc1cccc(c1)N1C(=N/C(=C/c2cc(n(c2C)C(C)C)C)/C1=O)O

STK596993
Synonyms: 1H-[1,2,4]triazolo[4,3-b][1,2,4]triazole-3,6-diamine
Smiles: Nc1nc2n(n1)c(n[nH]2)N

STK596996
Synonyms: N-cyclopropyl-2-(7,8-dihydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2O)O)NC1CC1

STK596997
Synonyms: 3-(2-hydroxy-3,5-dimethylphenyl)-5-(3-hydroxypropyl)-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: OCCCN1C(=O)c2c(C1c1ccc(cc1)OC)c([nH]n2)c1cc(C)cc(c1O)C

STK852635
Synonyms: 3-(4-fluorophenyl)-6-phenyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: Fc1ccc(cc1)c1nnc2n1nc(s2)c1ccccc1

STK596999
Synonyms: N'-[5-tert-butyl-3-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N,N-dimethylpropane-1,3-diamine
Smiles: CN(CCCNc1cc(nc2n1ncc2c1ccc(cc1)Cl)C(C)(C)C)C

STK597000
Synonyms: 3-(4-fluorophenyl)-2-[(2-hydroxyethyl)amino]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: OCCNc1nc2sc3c(c2c(=O)n1c1ccc(cc1)F)CCCCC3

STK597002
Synonyms: 1-(4-bromobutyl)-4-hydroxypyrimidin-2(1H)-one
Smiles: Oc1ccn(c(=O)n1)CCCCBr

STK597003
Synonyms: (2'S,3R,7a'S)-5-chloro-N-(4-methoxyphenyl)-7-methyl-2-oxo-1,1',2,2',5',6',7',7a'-octahydrospiro[indole-3,3'-pyrrolizine]-2'-carboxamide
Smiles: COc1ccc(cc1)NC(=O)[C@H]1C[C@H]2N([C@@]31C(=O)Nc1c3cc(Cl)cc1C)CCC2

STK597010
Synonyms: 2-[(2,3-dichlorophenyl)amino]-8-methyl-4-(4-methylphenyl)-4H-pyrimido[1,2-a][1,3,5]triazin-6-ol
Smiles: Cc1ccc(cc1)C1N=C(Nc2cccc(c2Cl)Cl)N=c2n1c(O)cc(n2)C

STK597011
Synonyms: N-(3-methoxypropyl)-2-[(2-oxo-4-propyl-2H-chromen-7-yl)oxy]acetamide
Smiles: CCCc1cc(=O)oc2c1ccc(c2)OCC(=O)NCCCOC

STK852637
Synonyms: 3-(2-chlorophenyl)-2,5-dimethyl-N-(tetrahydrofuran-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Cc1cc(NCC2CCCO2)n2c(n1)c(c(n2)C)c1ccccc1Cl

STK852638
Synonyms: N-(4-{[3-phenyl-5-(propan-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]amino}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)Nc1cc(nc2n1ncc2c1ccccc1)C(C)C

STK852639
Synonyms: N-[(2Z)-6-ethoxy-1,3-benzothiazol-2(3H)-ylidene]-4-oxo-1-phenyl-1,4-dihydropyridazine-3-carboxamide
Smiles: CCOc1ccc2c(c1)s/c(=N\C(=O)c1nn(ccc1=O)c1ccccc1)/[nH]2

STK597016
Synonyms: 8-amino-N-(propan-2-yl)-3,4-dihydro-2H-1,4-ethanothieno[2,3-b][1,5]naphthyridine-7-carboxamide
Smiles: CC(NC(=O)c1sc2c(c1N)cc1c(n2)C2CCN1CC2)C

STK597021
Synonyms: (2Z)-2-(4-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl3,4-dimethoxybenzoate
Smiles: COc1ccc(cc1OC)C(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)[N+](=O)[O-])/C2=O

STK597022
Synonyms: 2-(2,4-dimethoxyphenyl)-1-(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)ethanone
Smiles: COc1ccc(c(c1)OC)CC(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1

STK597023
Synonyms: 7-(2,5-dimethylphenyl)-3-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Cc1ccc(c(c1)n1ncc2c1ncn1c2nnc1c1ccccc1)C

STK597024
Synonyms: N-[(5Z)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzenesulfonamide
Smiles: S=C1S/C(=C\c2nc3c([nH]2)cccc3)/C(=O)N1NS(=O)(=O)c1ccccc1

STK597025
Synonyms: 2-benzyl-12-(furan-2-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
Smiles: Oc1ccc2c(c1)Oc1c(C2c2ccco2)c2nc(nn2cn1)Cc1ccccc1

STK852642
Synonyms: 4-hydroxy-2-(4-phenylpiperazin-1-yl)-1,3-diazaspiro[5.5]undeca-1,3-diene-5-carbonitrile
Smiles: N#CC1C(=NC(=NC21CCCCC2)N1CCN(CC1)c1ccccc1)O

STK597028
Synonyms: methylN-(cyclooctylcarbamoyl)-D-valinate
Smiles: COC(=O)[C@@H](C(C)C)NC(=O)NC1CCCCCCC1

STK852643
Synonyms: 3-(4-chlorophenyl)-2,5-dimethyl-6-propylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: CCCc1c(C)nc2n(c1O)nc(c2c1ccc(cc1)Cl)C

STK852644
Synonyms: ethyl4-(3-hydroxyphenyl)-2-methyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1)O)c1ccccc1[nH]2

STK597037
Synonyms:
Smiles: CCC([C@H](C(=O)OC)NC(=O)NC(C)C)C

STK597041
Synonyms: 2-(4-methoxyphenyl)-12-(pyridin-3-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
Smiles: COc1ccc(cc1)c1nc2n(n1)cnc1c2C(c2cccnc2)c2c(O1)cc(cc2)O

STK852648
Synonyms: 3-[(3-methoxyphenyl)amino]-2-benzofuran-1(3H)-one
Smiles: COc1cccc(c1)NC1OC(=O)c2c1cccc2

STK597044
Synonyms: 9-methoxy-6-[2-(naphthalen-2-yloxy)ethyl]-6H-indolo[2,3-b]quinoxaline
Smiles: COc1ccc2c(c1)c1nc3ccccc3nc1n2CCOc1ccc2c(c1)cccc2

STK597045
Synonyms: (2E)-2-cyano-N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-{3-[2-methyl-4-(propan-2-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}prop-2-enamide
Smiles: N#C/C(=C\c1cn(nc1c1ccc(cc1C)OC(C)C)c1ccccc1)/C(=O)NC1CCS(=O)(=O)C1

STK597046
Synonyms: (6aS,6bR,9aS,10R)-10-(phenylcarbonyl)-8-propyl-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: CCCN1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1[C@H]2C=Cc2c1cccc2)C(=O)c1ccccc1

STK852651
Synonyms: N-[(2Z)-6-(methylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]thiophene-2-carboxamide
Smiles: O=C(c1cccs1)/N=c/1\sc2c([nH]1)ccc(c2)S(=O)(=O)C

STK597053
Synonyms: 12-phenyl-2-(pyridin-2-yl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Smiles: O=C1CCCC2=C1C(c1ccccc1)c1c(O2)ncn2c1nc(n2)c1ccccn1

STK597058
Synonyms: 3-chloro-N-[2-(furan-2-yl)-2-(pyrrolidin-1-yl)ethyl]-6-methyl-1-benzothiophene-2-carboxamide
Smiles: Cc1ccc2c(c1)sc(c2Cl)C(=O)NCC(c1ccco1)N1CCCC1

STK597061
Synonyms: (3R)-5-oxo-N-(propan-2-yl)-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: CC(NC(=O)[C@@H]1CSC2N1C(=O)c1c2cccc1)C

STK597063
Synonyms: (2S)-[({[(2E)-2-(4-methoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)amino](phenyl)ethanoicacid
Smiles: COc1ccc(cc1)/C=C\1/Oc2c(C1=O)ccc(c2)OCC(=O)N[C@@H](c1ccccc1)C(=O)O

STK597066
Synonyms: N'-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetyl]-4-methoxybenzohydrazide
Smiles: COc1ccc(cc1)C(=O)NNC(=O)Cc1nn2c(n1)nc(cc2C)C

STK597067
Synonyms: (5E)-5-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-3-(2-methylpropyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CC(CN1C(=S)S/C(=C/c2ccc3c(c2)CC(O3)C)/C1=O)C

STK597068
Synonyms: methylN-[(4-methylphenyl)carbamoyl]-D-phenylalaninate
Smiles: COC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccc(cc1)C

STK597069
Synonyms: 3-[(4-fluorobenzyl)oxy]-1-hydroxy-5-methyl-9H-xanthen-9-one
Smiles: Fc1ccc(cc1)COc1cc(O)c2c(c1)oc1c(c2=O)cccc1C

STK852654
Synonyms: 7-fluoro-2-(3-methoxypropyl)-1'-methyl-2H-spiro[chromeno[2,3-c]pyrrole-1,3'-indole]-2',3,9(1'H)-trione
Smiles: COCCCN1C(=O)c2c(C31C(=O)N(c1c3cccc1)C)c(=O)c1c(o2)ccc(c1)F

STK597075
Synonyms: 3-[7-(3,4-dimethylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]naphthalen-2-ol
Smiles: Oc1cc2ccccc2cc1c1nn2c(n1)c1cnn(c1nc2)c1ccc(c(c1)C)C

STK597076
Synonyms: 9-(3,5-difluorophenyl)-2-(trifluoromethyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: Fc1cc(cc(c1)F)C1C2=C(O)CCCC2=Nc2n1nc(n2)C(F)(F)F

STK852655
Synonyms: propan-2-yl2-methyl-5-[(morpholin-4-ylcarbonyl)oxy]-1H-indole-3-carboxylate
Smiles: CC(OC(=O)c1c(C)[nH]c2c1cc(cc2)OC(=O)N1CCOCC1)C

STK597082
Synonyms: 3-[2-(9-methoxy-6H-indolo[2,3-b]quinoxalin-6-yl)ethyl]-1,3-benzoxazol-2(3H)-one
Smiles: COc1ccc2c(c1)c1nc3ccccc3nc1n2CCn1c(=O)oc2c1cccc2

STK597084
Synonyms: 7-(4-methoxyphenyl)-14H-chromeno[2',3':4,5]pyrimido[1,6-a]benzimidazol-14-one
Smiles: COc1ccc(cc1)c1nc2oc3ccccc3c(=O)c2c2n1c1ccccc1n2

STK597085
Synonyms: 2-methyl-9-[4-(2-methylprop-2-en-1-yl)piperazin-1-yl]-3-phenyl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazoline
Smiles: CC(=C)CN1CCN(CC1)c1c2CCCCc2nc2n1nc(c2c1ccccc1)C

STK597086
Synonyms: 5-tert-butyl-3-(4-methylphenyl)-7-(4-methylpiperazin-1-yl)pyrazolo[1,5-a]pyrimidine
Smiles: CN1CCN(CC1)c1cc(nc2n1ncc2c1ccc(cc1)C)C(C)(C)C

STK597091
Synonyms: 2-methoxyethyl2,5-dimethyl-7-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Smiles: COCCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)nc([nH]2)C

STK597094
Synonyms: N-[2-(4-tert-butylphenyl)-5-hydroxy[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]furan-2-carboxamide
Smiles: Oc1cc(NC(=O)c2ccco2)n2c(n1)nc(n2)c1ccc(cc1)C(C)(C)C

STK597095
Synonyms: N-[2-(4-chlorophenyl)-5-hydroxy[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1cc(O)nc2n1nc(n2)c1ccc(cc1)Cl

STK597097
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-5-(5-ethyl-2-hydroxyphenyl)-1H-pyrazole-3-carboxamide
Smiles: CCc1ccc(c(c1)c1[nH]nc(c1)C(=O)NC1CCS(=O)(=O)C1)O

STK597099
Synonyms: 2-methyl-7-(4-methylpiperazin-1-yl)-3,5-diphenylpyrazolo[1,5-a]pyrimidine
Smiles: CN1CCN(CC1)c1cc(nc2n1nc(c2c1ccccc1)C)c1ccccc1

STK852659
Synonyms: 2-methyl-3-phenyl-5-(propan-2-yl)-N-(tetrahydrofuran-2-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CC(c1cc(NCC2CCCO2)n2c(n1)c(c1ccccc1)c(n2)C)C

STK597105
Synonyms: ethyl4-{[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)carbonyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)c1nn2c(n1)nc(cc2C)C

STK597111
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-5,6-dimethoxy-N-methyl-1H-indole-2-carboxamide
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)N(C1CCS(=O)(=O)C1)C

STK597115
Synonyms: 2-phenyl-9-propyl-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CCCN1CCc2c(C1)sc1c2c2nc(nn2cn1)c1ccccc1

STK597119
Synonyms: N-{[2-(morpholin-4-yl)ethyl]carbamoyl}-L-leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)NCCN1CCOCC1)C

STK852662
Synonyms: N-(5-methyl-1,2-oxazol-3-yl)-1-oxo-1H-isochromene-3-carboxamide
Smiles: Cc1onc(c1)NC(=O)c1cc2ccccc2c(=O)o1

STK597120
Synonyms: 5-tert-butyl-3-(4-chlorophenyl)-N-(1-phenylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(cc2NC(c1ccccc1)C)C(C)(C)C

STK597121
Synonyms: N-[3-(3,4-dimethoxyphenyl)-1-methyl-4-oxo-1,4-dihydroquinolin-2-yl]-3-methylbenzamide
Smiles: COc1cc(ccc1OC)c1c(NC(=O)c2cccc(c2)C)n(C)c2c(c1=O)cccc2

STK597123
Synonyms: (5Z)-3-cyclohexyl-6-hydroxy-5-{1-[(tetrahydrofuran-2-ylmethyl)amino]propylidene}pyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C/1\C(=NC(=O)N(C1=O)C1CCCCC1)O)/NCC1CCCO1

STK852663
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-ethyl-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CCc1c(C)nc2n(c1NCCc1ccc(c(c1)OC)OC)nc(c2c1ccccc1)C

STK597128
Synonyms: N-[2-(furan-2-yl)-5-hydroxy[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]thiophene-2-carboxamide
Smiles: Oc1cc(NC(=O)c2cccs2)n2c(n1)nc(n2)c1ccco1

STK597131
Synonyms: 6-ethyl-2-oxo-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2H-chromen-7-olate
Smiles: CCc1cc2c(cc1[O-])oc(=O)cc2C[NH+]1CCN(CC1)c1ccccc1

STK597133
Synonyms: (5Z)-5-[1-acetyl-5-(4-chlorophenyl)pyrazolidin-3-ylidene]-6-hydroxy-3-(3-methoxypropyl)pyrimidine-2,4(3H,5H)-dione
Smiles: COCCCN1C(=O)N=C(/C(=C\2/NN(C(C2)c2ccc(cc2)Cl)C(=O)C)/C1=O)O

STK597135
Synonyms: 6,7,10-trimethyl-3-(pyridin-2-ylmethyl)-3,4-dihydro-2H,8H-chromeno[6,7-e][1,3]oxazin-8-one
Smiles: O=c1oc2c(C)c3OCN(Cc3cc2c(c1C)C)Cc1ccccn1

STK852667
Synonyms: 2-[(4,8-dimethylquinazolin-2-yl)amino]-6-methyl-5-pentylpyrimidin-4-ol
Smiles: CCCCCc1c(C)nc(nc1O)Nc1nc(C)c2c(n1)c(C)ccc2

STK852668
Synonyms: 2-(2-chlorophenoxy)-N-[4-(4-methoxyphenyl)-1,2,5-oxadiazol-3-yl]acetamide
Smiles: COc1ccc(cc1)c1nonc1NC(=O)COc1ccccc1Cl

STK597137
Synonyms: ethyl2-amino-4-(2,3-dichlorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C1c1cccc(c1Cl)Cl)oc(cc2=O)CO

STK852669
Synonyms: 3-(4-chlorophenyl)-5-methyl-N-(propan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CC(Nc1cc(C)nc2n1ncc2c1ccc(cc1)Cl)C

STK852670
Synonyms: ethyl6-bromo-5-(2-methoxy-2-oxoethoxy)-2-methyl-1-benzofuran-3-carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OCC(=O)OC)c(c2)Br

STK597148
Synonyms: (4E)-4-benzylidene-2-(2,4-dichlorophenyl)-4H-imidazol-5-ol
Smiles: Clc1ccc(c(c1)Cl)C1=N/C(=C/c2ccccc2)/C(=N1)O

STK852671
Synonyms: methyl6-(benzylsulfanyl)-5-cyano-4-(4-ethoxyphenyl)-2-hydroxy-3,4-dihydropyridine-3-carboxylate
Smiles: CCOc1ccc(cc1)C1C(C(=O)OC)C(=NC(=C1C#N)SCc1ccccc1)O

STK597157
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-methylacetamide
Smiles: CC(=O)N(C1CCS(=O)(=O)C1)C

STK852673
Synonyms: 7-chloro-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)Cl

STK597160
Synonyms: 2-[5-(4-chlorophenyl)pyrimidin-4-yl]-5-[(2,5-dimethylbenzyl)oxy]phenol
Smiles: Clc1ccc(cc1)c1cncnc1c1ccc(cc1O)OCc1cc(C)ccc1C

STK597167
Synonyms: {2-[(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#CCOc1ccccc1C1=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

STK597170
Synonyms: 2-[(4-fluorobenzyl)amino]-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-ol
Smiles: Fc1ccc(cc1)CNc1nc2n(n1)c(O)c1c(n2)CCC1

STK597171
Synonyms: 6-(2-hydroxyphenyl)-9-(4-hydroxyphenyl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CSc1nc2n(n1)C(c1ccc(cc1)O)C1=C(O)CC(CC1=N2)c1ccccc1O

STK852676
Synonyms: 1-methyl-N-(naphthalen-1-yl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: O=c1c2cc(n(c2nc2n1cccc2)C)C(=O)Nc1cccc2c1cccc2

STK597181
Synonyms: methylN-[(5-methoxy-3-methyl-1H-indol-2-yl)carbonyl]glycinate
Smiles: COC(=O)CNC(=O)c1[nH]c2c(c1C)cc(cc2)OC

STK597182
Synonyms: 6,6-dimethyl-9-(3-methylthiophen-2-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: OC1=C2C(=Nc3n(C2c2sccc2C)ncn3)CC(C1)(C)C

STK852678
Synonyms: N-(3,5-dichlorophenyl)-2-hydroxy-5-oxo-3,4,5,6,7,8-hexahydroquinoline-4-carboxamide
Smiles: OC1=NC2=C(C(C1)C(=O)Nc1cc(Cl)cc(c1)Cl)C(=O)CCC2

STK852679
Synonyms: 1-(4-chlorophenyl)-3-hydroxychromeno[2,3-c]pyrrol-9(1H)-one
Smiles: Clc1ccc(cc1)C1N=C(c2c1c(=O)c1c(o2)cccc1)O

STK597191
Synonyms: 2-[(6-oxo-6H-benzo[c]chromen-3-yl)oxy]-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
Smiles: O=C(COc1ccc2c(c1)oc(=O)c1c2cccc1)NCCCN1CCCC1=O

STK597193
Synonyms: (1E)-N-[(9-methyl-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]-1-phenylethanimine
Smiles: CN1CCc2c(C1)sc1c2c2nc(nn2cn1)CO/N=C(/c1ccccc1)\C

STK852680
Synonyms: 3-(2-methoxyphenoxy)-4-oxo-4H-chromen-7-ylthiophene-2-carboxylate
Smiles: COc1ccccc1Oc1coc2c(c1=O)ccc(c2)OC(=O)c1cccs1

STK597200
Synonyms: (3R)-N-(furan-2-ylmethyl)-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: O=C1c2ccccc2C2N1[C@H](C(=O)NCc1ccco1)C(S2)(C)C

STK597201
Synonyms: N-[(4-chlorophenyl)carbamoyl]-L-phenylalanine
Smiles: O=C(N[C@H](C(=O)O)Cc1ccccc1)Nc1ccc(cc1)Cl

STK597202
Synonyms: 7,8-dichloro[1,2,5]thiadiazolo[3,4-f]quinoxaline
Smiles: Clc1nc2ccc3c(c2nc1Cl)nsn3

STK597205
Synonyms: (3E)-3-[(4-chloro-2,5-dimethoxyphenyl)imino]-5-(4-fluorophenyl)cyclohex-1-en-1-ol
Smiles: COc1cc(Cl)c(cc1/N=C\1/C=C(O)CC(C1)c1ccc(cc1)F)OC

STK597208
Synonyms: 2-[2-(3,4-dimethoxyphenyl)ethyl]-5,7-dimethyl-1-[4-(propan-2-yl)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1ccc(cc1OC)CCN1C(=O)c2c(C1c1ccc(cc1)C(C)C)c(=O)c1c(o2)c(C)cc(c1)C

STK852681
Synonyms: N-(4-{[3-(4-chlorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]amino}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)Nc1cc(C)nc2n1ncc2c1ccc(cc1)Cl

STK597210
Synonyms: N-{N-[2-chloro-5-(trifluoromethyl)phenyl]-N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl}-2,2,2-trifluoroacetamide
Smiles: Cc1cc(C)nc(n1)/N=C(\Nc1cc(ccc1Cl)C(F)(F)F)/NC(=O)C(F)(F)F

STK852682
Synonyms: (5E)-3-(3-chlorophenyl)-5-[2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene]-2-hydroxy-3,5-dihydro-4H-imidazol-4-one
Smiles: COc1cc(N2CCCC2)c(cc1/C=C\1/N=C(N(C1=O)c1cccc(c1)Cl)O)OC

STK597216
Synonyms: 7-methyl-2-oxo-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2H-chromen-5-olate
Smiles: Cc1cc([O-])c2c(c1)oc(=O)cc2C[NH+]1CCN(CC1)c1ccccc1

STK597220
Synonyms: N'-[2-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetyl]naphthalene-1-carbohydrazide
Smiles: O=C(Cc1nn2c(n1)nc(cc2C)C)NNC(=O)c1cccc2c1cccc2

STK597221
Synonyms: N-[3-(1H-imidazol-1-yl)propyl]-2-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2cccs2)/C1=O)NCCCn1cncc1

STK597223
Synonyms: N-benzyl-3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]propanamide
Smiles: O=C(CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)NCc1ccccc1

STK852684
Synonyms: N-[(2Z)-3-(2-chlorobenzyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: CC(=O)/N=C/1\SC2C(N1Cc1ccccc1Cl)CS(=O)(=O)C2

STK597224
Synonyms: 1-[2,10-bis(4-methoxyphenyl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
Smiles: COc1ccc(cc1)c1nc2n(n1)cnc1c2C(c2ccc(cc2)OC)C(=C(O1)C)C(=O)C

STK597225
Synonyms: 5-tert-butyl-3-(4-chlorophenyl)-N-(4-fluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Fc1ccc(cc1)Nc1cc(nc2n1nc(c2c1ccc(cc1)Cl)C)C(C)(C)C

STK852685
Synonyms: 2-methyl-N-[2-(morpholin-4-yl)ethyl]-3-phenyl-5-(propan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CC(c1cc(NCCN2CCOCC2)n2c(n1)c(c1ccccc1)c(n2)C)C

STK597227
Synonyms: 11-methyl-3-(thiophen-2-yl)-3,4-dihydro-2H-dibenzo[b,e][1,4]diazepin-1-ol
Smiles: OC1=C2C(=Nc3c(N=C2CC(C1)c1cccs1)cccc3)C

STK597228
Synonyms: 8-fluoro-3-(2-hydroxyethyl)-5-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: OCCn1cnc2c(c1=O)n(C)c1c2cc(cc1)F

STK597229
Synonyms: 2,2-dimethyl-8-(4-methylpiperazin-1-yl)-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidine
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3N1CCN(CC1)C

STK852687
Synonyms: ethyl{[3-cyano-6-hydroxy-4-(3-nitrophenyl)-4,5-dihydropyridin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSC1=C(C#N)C(CC(=N1)O)c1cccc(c1)[N+](=O)[O-]

STK597230
Synonyms: 2-{[7,7-dimethyl-2-(4-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}ethanol
Smiles: OCCSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)C

STK597235
Synonyms: 2,8,10-trimethyl-4-[4-(pyridin-2-yl)piperazin-1-yl]pyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidine
Smiles: Cc1cc(N2CCN(CC2)c2ccccn2)n2c(n1)c1c(C)cc(nc1n2)C

STK597236
Synonyms: {(3E)-2-(4-bromophenyl)-3-[hydroxy(4-methylphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}aceticacid
Smiles: OC(=O)CN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/O)/C1c1ccc(cc1)Br

STK597238
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-methyl-2-[(5E)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]acetamide
Smiles: O=C(N(C1CCS(=O)(=O)C1)C)CN1C(=S)S/C(=C/c2cccs2)/C1=O

STK597239
Synonyms: 1-(4-ethoxy-3-methoxyphenyl)-5,7-dimethyl-2-(pyridin-3-ylmethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1ccc(cc1OC)C1N(Cc2cccnc2)C(=O)c2c1c(=O)c1c(o2)c(C)cc(c1)C

STK597243
Synonyms: N-[3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]glycylglycyl-N-[(trans-4-carboxycyclohexyl)methyl]glycinamide
Smiles: O=C(CNC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1C)C)NCC(=O)NCC(=O)NC[C@@H]1CC[C@H](CC1)C(=O)O

STK597246
Synonyms: ethyl1-[(1-benzyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-2-yl)carbonyl]piperidine-4-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)C(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1

STK852688
Synonyms: 2-(2,3-dihydro-1H-indol-1-yl)-5,6,7,8-tetrahydroquinazolin-4-ol
Smiles: Oc1nc(nc2c1CCCC2)N1CCc2c1cccc2

STK852689
Synonyms: 2-(piperidin-1-yl)-5,6,7,8-tetrahydroquinazolin-4-ol
Smiles: Oc1nc(nc2c1CCCC2)N1CCCCC1

STK597253
Synonyms: 5-tert-butyl-N-cyclopentyl-3-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Cc1ccc(cc1)c1cnn2c1nc(cc2NC1CCCC1)C(C)(C)C

STK597257
Synonyms: (5Z)-5-{[1-(3,4-dichlorobenzyl)-1H-indol-3-yl]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: O=C1NC(=O)/C(=C\c2cn(c3c2cccc3)Cc2ccc(c(c2)Cl)Cl)/C(=N1)O

STK597258
Synonyms: 5-[(4-chlorobenzyl)oxy]-2-(4-phenyl-1H-pyrazol-5-yl)phenol
Smiles: Clc1ccc(cc1)COc1ccc(c(c1)O)c1[nH]ncc1c1ccccc1

STK597263
Synonyms: 5-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-2-(methylsulfanyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: CSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1ccc(c(c1)OC)O

STK852691
Synonyms: 3-(2-hydroxyphenyl)-4-(3-hydroxyphenyl)-5-[3-(propan-2-yloxy)propyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: CC(OCCCN1C(=O)c2c(C1c1cccc(c1)O)c([nH]n2)c1ccccc1O)C

STK597272
Synonyms: N-[(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]norvalyl-L-phenylalanine
Smiles: CCCC(C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)OC)Cl

STK597273
Synonyms: (2E)-2-cyano-N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-{3-[2-methyl-4-(2-methylpropoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}prop-2-enamide
Smiles: N#C/C(=C\c1cn(nc1c1ccc(cc1C)OCC(C)C)c1ccccc1)/C(=O)NC1CCS(=O)(=O)C1

STK597278
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(1E)-1-(naphthalen-1-yl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C(/c1cccc2c1cccc2)\C

STK852693
Synonyms: 4-(3-chlorophenyl)-5-(furan-2-ylmethyl)-3-(2-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: Clc1cccc(c1)C1N(Cc2ccco2)C(=O)c2c1c([nH]n2)c1ccccc1O

STK852694
Synonyms: 2-[2-amino-5-(2-ethoxyphenoxy)pyrimidin-4-yl]-5-[(4-methylbenzyl)oxy]phenol
Smiles: CCOc1ccccc1Oc1cnc(nc1c1ccc(cc1O)OCc1ccc(cc1)C)N

STK597282
Synonyms: [4-(benzyloxy)-3-methoxyphenyl](6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
Smiles: COc1cc(ccc1OCc1ccccc1)C(=O)N1CCc2c(C1)cc(c(c2)OC)OC

STK597289
Synonyms: 2-({4-amino-5-[5-(4-chlorophenyl)-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)Cl

STK852699
Synonyms: 8-(2-chlorophenyl)-3-(furan-2-ylmethyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccccc1Cl)Cc1ccco1

STK597296
Synonyms: 5-chloro-4-hydroxy-6-methyl-2-phenyl-1,2-dihydro-3H-pyrazolo[3,4-b]pyridin-3-one
Smiles: Cc1nc2[nH]n(c(=O)c2c(c1Cl)O)c1ccccc1

STK852700
Synonyms: (2Z)-2-(furan-2-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-ylpropanoate
Smiles: CCC(=O)Oc1ccc2c(c1)O/C(=C\c1ccco1)/C2=O

STK597305
Synonyms: (5E)-3-cyclohexyl-6-hydroxy-5-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C\NCCCn2cncc2)/C(=O)N1C1CCCCC1

STK597307
Synonyms: 2-[(4-ethyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]-N-(pyridin-3-ylmethyl)propanamide
Smiles: CCc1cc(=O)oc2c1c(cc(c2)C)OC(C(=O)NCc1cccnc1)C

STK597308
Synonyms: 5-tert-butyl-3-(2-chlorophenyl)-7-(4-methylpiperazin-1-yl)pyrazolo[1,5-a]pyrimidine
Smiles: CN1CCN(CC1)c1cc(nc2n1ncc2c1ccccc1Cl)C(C)(C)C

STK597309
Synonyms: (2R)-N-ethyl-1-[3-(trifluoromethyl)phenyl]propan-2-amine
Smiles: CCNC(Cc1cccc(c1)C(F)(F)F)C

STK852701
Synonyms: 8,10-dimethyl-2-propyl-N-(tetrahydrofuran-2-ylmethyl)pyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-4-amine
Smiles: CCCc1cc(NCC2CCCO2)n2c(n1)c1c(C)cc(nc1n2)C

STK597313
Synonyms: N-cyclohexyl-2-methyl-3-phenyl-5-(propan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CC(c1cc(NC2CCCCC2)n2c(n1)c(c1ccccc1)c(n2)C)C

STK597315
Synonyms: 5-(2,6-dichlorobenzyl)pyrimidine-2,4,6-triol
Smiles: Oc1nc(O)c(c(n1)O)Cc1c(Cl)cccc1Cl

STK852702
Synonyms: (2R)-2-[(2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)ammonio]propanoate
Smiles: Cc1nc([NH2+][C@@H](C(=O)[O-])C)c2c(n1)c1ccccc1o2

STK852703
Synonyms: 1-benzyl-N-(1,1-dioxidotetrahydrothiophen-3-yl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: O=c1c2cc(n(c2nc2n1cccc2)Cc1ccccc1)C(=O)NC1CCS(=O)(=O)C1

STK852704
Synonyms: 2-[(2-methoxyphenoxy)methyl]-8,9-dimethylfuro[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccccc1OCc1nn2c(n1)c1c(nc2)oc(c1C)C

STK852705
Synonyms: (2Z)-2-(furan-2-ylmethylidene)-7-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-yl3,4,5-trimethoxybenzoate
Smiles: COc1cc(cc(c1OC)OC)C(=O)Oc1ccc2c(c1C)O/C(=C\c1ccco1)/C2=O

STK597321
Synonyms: N-(4-fluorophenyl)-2-hydroxy-5-oxo-3,4,5,6,7,8-hexahydroquinoline-4-carboxamide
Smiles: OC1=NC2=C(C(C1)C(=O)Nc1ccc(cc1)F)C(=O)CCC2

STK597322
Synonyms: 4-{[6-(4-acetyl-5-methyl-1H-pyrazol-1-yl)pyrimidin-4-yl]oxy}benzonitrile
Smiles: N#Cc1ccc(cc1)Oc1ncnc(c1)n1ncc(c1C)C(=O)C

STK597323
Synonyms: 5-tert-butyl-N-(2-methoxyethyl)-3-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: COCCNc1cc(nc2n1ncc2c1ccc(cc1)C)C(C)(C)C

STK852706
Synonyms: 2-(4-hydroxy-2-imino-2,5-dihydro-1,3-thiazol-5-yl)-N-(3-methylphenyl)acetamide
Smiles: O=C(CC1SC(=N)N=C1O)Nc1cccc(c1)C

STK597327
Synonyms: 6-hydroxy-1,3-dimethyl-5-(naphthalen-1-yl)-5,7,8,9-tetrahydropyrimido[4,5-b]quinoline-2,4(1H,3H)-dione
Smiles: OC1=C2C(=Nc3c(C2c2cccc4c2cccc4)c(=O)n(c(=O)n3C)C)CCC1

STK597331
Synonyms: 2-(ethylsulfanyl)-9-(3-methylthiophen-2-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CCSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1sccc1C

STK597332
Synonyms: 2-{2-[4-(4-methoxyphenyl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethyl}phthalazin-1(2H)-one
Smiles: COc1ccc(cc1)n1c(n[nH]c1=S)CCn1ncc2c(c1=O)cccc2

STK597333
Synonyms: (5s,7s)-2-[4-(benzyloxy)phenyl]-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: O=C1[C@]2(C)CN3C[C@@]1(C)CN(C2)C3c1ccc(cc1)OCc1ccccc1

STK597335
Synonyms: 3-(3-methoxypropyl)-3,4,7,8,9,10-hexahydro-2H,6H-benzo[3,4]chromeno[8,7-e][1,3]oxazin-6-one
Smiles: COCCCN1COc2c(C1)c1oc(=O)c3c(c1cc2)CCCC3

STK597337
Synonyms: 6'-chloro-1',2',3',3a'-tetrahydro-5'H-spiro[furan-3,4'-pyrrolo[1,2-a]quinoline]-2,4(5H)-dione
Smiles: Clc1cccc2c1CC1(C(=O)COC1=O)C1N2CCC1

STK597339
Synonyms: N'-(5,6-dimethyl-7-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N,N-dimethylpropane-1,3-diamine
Smiles: CN(CCCNc1ncnc2c1c(C)c(n2c1ccccc1)C)C

STK597340
Synonyms: 7-bromo-2-(4-methylpyridin-2-yl)-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Cc1ccnc(c1)N1C(=O)c2c(C1c1ccc(cc1)[N+](=O)[O-])c(=O)c1c(o2)ccc(c1)Br

STK852712
Synonyms: methyl4-(2-methyl-3,9-dioxo-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK597343
Synonyms: 11-(furan-2-yl)-10-methyl-2-(phenoxymethyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1nn(c2c1C(c1ccco1)c1c(O2)ncn2c1nc(n2)COc1ccccc1)c1ccccc1

STK597346
Synonyms: 2-[4-(diphenylmethyl)piperazin-1-yl]-5,6-dimethylpyrimidin-4-ol
Smiles: Cc1nc(nc(c1C)O)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK597353
Synonyms: 2-chloro-N-[(2Z)-3-(3-methoxyphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide
Smiles: ClCC(=O)/N=C/1\SC2C(N1c1cccc(c1)OC)CS(=O)(=O)C2

STK597356
Synonyms: 10-[(2-aminoethyl)amino]-9-(3-chlorophenyl)-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one
Smiles: NCCNc1nc2c3c(sc2c(=O)n1c1cccc(c1)Cl)nc(c1c3CC(C)(C)OC1)C

STK852714
Synonyms: ethyl3-amino-7-propyl-7,8-dihydro-5H-pyrano[4,3-b]thieno[3,2-e]pyridine-2-carboxylate
Smiles: CCCC1OCc2c(C1)nc1c(c2)c(c(s1)C(=O)OCC)N

STK597361
Synonyms: 6-ethyl-5-methyl-2-(phenoxymethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: CCc1c(C)nc2n(c1O)nc(c2c1ccccc1)COc1ccccc1

STK597362
Synonyms: 10-(3-hydroxyphenyl)-5-(4-methoxyphenyl)-1,3,7,7-tetramethyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Smiles: COc1ccc(cc1)c1c2c(=O)n(C)c(=O)n(c2c2n1C(C)(C)COC2c1cccc(c1)O)C

STK597371
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)c1cccc(c1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)C

STK597375
Synonyms: 5-bromo-N-(2-methoxyphenyl)-3-methyl-1H-indole-2-carboxamide
Smiles: COc1ccccc1NC(=O)c1[nH]c2c(c1C)cc(cc2)Br

STK597376
Synonyms: 3-(2-hydroxy-3,5-dimethylphenyl)-4-[3-(3-methylbutoxy)phenyl]-5-(pyridin-3-ylmethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: CC(CCOc1cccc(c1)C1N(Cc2cccnc2)C(=O)c2c1c([nH]n2)c1cc(C)cc(c1O)C)C

STK597378
Synonyms: 5-(thiophen-2-yl)thieno[2,3-d]pyrimidin-4-ol
Smiles: Oc1ncnc2c1c(cs2)c1cccs1

STK597379
Synonyms: 3-(pyrrolidin-1-yl)quinoxalin-2-amine
Smiles: Nc1nc2ccccc2nc1N1CCCC1

STK597380
Synonyms: 2-[2-amino-5-(4-chlorophenyl)pyrimidin-4-yl]-5-[(2-chlorobenzyl)oxy]phenol
Smiles: Clc1ccc(cc1)c1cnc(nc1c1ccc(cc1O)OCc1ccccc1Cl)N

STK597382
Synonyms: 2-[(1,3-benzoxazol-2-ylsulfanyl)methyl]-9-methyl-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CN1CCc2c(C1)sc1c2c2nc(nn2cn1)CSc1nc2c(o1)cccc2

STK852719
Synonyms: 3-(3,4-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl4-bromobenzoate
Smiles: COc1cc(ccc1OC)c1coc2c(c1=O)ccc(c2)OC(=O)c1ccc(cc1)Br

STK597390
Synonyms: N-[4-(4-methoxyphenyl)-1,2,5-oxadiazol-3-yl]-2-propoxybenzamide
Smiles: CCCOc1ccccc1C(=O)Nc1nonc1c1ccc(cc1)OC

STK597394
Synonyms: 1-[2-(4-methoxybenzyl)-10-(4-methoxyphenyl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
Smiles: COc1ccc(cc1)Cc1nc2n(n1)cnc1c2C(c2ccc(cc2)OC)C(=C(O1)C)C(=O)C

STK852722
Synonyms: 8-benzyl-1,7-dimethyl-3-(2-methylpropyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CC(Cn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)Cc1ccccc1)C)C

STK597399
Synonyms: 6-methyl-9-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CC1CC(=C2C(=Nc3n(C2c2ccccc2)ncn3)C1)O

STK852723
Synonyms: 4-(3-methoxyphenyl)-3-phenyl-2,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: COc1cccc(c1)C1CC(=O)Nc2c1c([nH]n2)c1ccccc1

STK597401
Synonyms: 10-(3,4-dihydroxyphenyl)-1,3,7,7-tetramethyl-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: Oc1cc(ccc1O)C1OCC(n2c1c1n(C)c(=O)n(c(=O)c1c2c1ccccc1)C)(C)C

STK597403
Synonyms: 1-{5-methyl-1-[6-(4-propylphenoxy)pyrimidin-4-yl]-1H-pyrazol-4-yl}ethanone
Smiles: CCCc1ccc(cc1)Oc1ncnc(c1)n1ncc(c1C)C(=O)C

STK597404
Synonyms: 4-chloro-N-[5-hydroxy-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1cc(O)nc2n1nc(n2)c1cccc(c1)C

STK852725
Synonyms: 3-(4-chlorophenyl)-6-ethyl-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: CCc1c(C)nc2n(c1O)nc(c2c1ccc(cc1)Cl)C

STK597408
Synonyms: 5-(4-chlorophenyl)-3-(2-hydroxyethyl)-4-imino-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
Smiles: OCCn1cnc2c(c1=N)C(c1ccc(cc1)Cl)c1c(O2)cc(cc1)O

STK597410
Synonyms: 2-({[(5Z)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetyl}amino)-5-hydroxybenzoicacid
Smiles: O=C(Nc1ccc(cc1C(=O)O)O)CN1C(=S)S/C(=C\c2ccccc2)/C1=O

STK852727
Synonyms: 4-(4-methylphenyl)-4,10-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
Smiles: Cc1ccc(cc1)C1N=C(N)N=c2n1c1ccccc1[nH]2

STK597417
Synonyms: 2-phenyl-4-(2,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydro-2H-pyrazolo[3,4-b]quinoline-3,5-diol
Smiles: COc1cc(OC)c(cc1C1C2=C(O)CCCC2=Nc2c1c(O)n(n2)c1ccccc1)OC

STK597421
Synonyms: 5-{[(2Z)-3-(3-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-5-oxopentanoicacid
Smiles: OC(=O)CCCC(=O)/N=C/1\SC2C(N1c1cccc(c1)F)CS(=O)(=O)C2

STK597424
Synonyms: 5-bromo-N-[2-(dimethylamino)ethyl]-3-methyl-1H-indole-2-carboxamide
Smiles: CN(CCNC(=O)c1[nH]c2c(c1C)cc(cc2)Br)C

STK597426
Synonyms: 2-butyl-4-hydroxy-N-(5-methyl-1,2-oxazol-3-yl)-2H-1,2-benzothiazine-3-carboxamide1,1-dioxide
Smiles: CCCCN1C(=C(O)c2c(S1(=O)=O)cccc2)C(=O)Nc1noc(c1)C

STK597429
Synonyms: (5Z)-2-{[4-chloro-2-(trifluoromethyl)phenyl]amino}-5-[(1-methyl-1H-indol-3-yl)methylidene]-1,3-thiazol-4(5H)-one
Smiles: Clc1ccc(c(c1)C(F)(F)F)NC1=NC(=O)/C(=C/c2cn(c3c2cccc3)C)/S1

STK597431
Synonyms: 4-(2,6-dimethylmorpholin-4-yl)-2-phenyl[1]benzofuro[3,2-d]pyrimidine
Smiles: CC1OC(C)CN(C1)c1nc(nc2c1oc1c2cccc1)c1ccccc1

STK597433
Synonyms: 3-(1,3-benzodioxol-5-ylmethyl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-imine5,5-dioxide
Smiles: N=C1SC2C(N1Cc1ccc3c(c1)OCO3)CS(=O)(=O)C2

STK852729
Synonyms: 1-(3-methoxypropyl)-9-methyl-4-oxo-N-(2-phenylethyl)-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCCc1ccccc1

STK597445
Synonyms: 4-(2,5-dimethoxyphenyl)-2-[(4-fluorophenyl)amino]-8-methyl-4H-pyrimido[1,2-a][1,3,5]triazin-6-ol
Smiles: COc1ccc(cc1C1N=C(Nc2ccc(cc2)F)N=c2n1c(O)cc(n2)C)OC

STK597453
Synonyms: N-[2-(furan-2-yl)-5-hydroxy[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]benzamide
Smiles: Oc1cc(NC(=O)c2ccccc2)n2c(n1)nc(n2)c1ccco1

STK597454
Synonyms: 2-hydroxy-1-(2-phenylethyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: CC(N1CNc2c(C1)c(=O)nc(n2CCc1ccccc1)O)C

STK852731
Synonyms: 2-(methylsulfanyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-ol
Smiles: CSc1nn2c(n1)nc1c(c2O)CCCC1

STK852732
Synonyms: 1-benzyl-N-(2-hydroxyethyl)-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: OCCNC(=O)c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1

STK597458
Synonyms: 4-{[7-(4-chlorophenyl)-5-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]amino}-4-oxobutanoicacid
Smiles: O=C(Nc1nn2c(=NC(=CC2c2ccc(cc2)Cl)c2ccccc2)[nH]1)CCC(=O)O

STK597459
Synonyms: ethyl10-(3,4-dimethoxyphenyl)-8-methyl-2-(pyridin-3-yl)-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-9-carboxylate
Smiles: CCOC(=O)C1=C(C)Oc2c(C1c1ccc(c(c1)OC)OC)c1nc(nn1cn2)c1cccnc1

STK597465
Synonyms: 2,4-dichloro-N'-{3-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}benzohydrazide
Smiles: O=C(NNC(=O)c1ccc(cc1Cl)Cl)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

STK852734
Synonyms: 7-(3,4-dimethylphenyl)-2-(4-ethylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CCc1ccc(cc1)c1nn2c(n1)c1cnn(c1nc2)c1ccc(c(c1)C)C

STK597469
Synonyms: N-[(7-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)acetamide
Smiles: Cc1ccc2c(c1)[nH]c(=O)c(c2)CN(C(=O)C)Cc1cccnc1

STK597470
Synonyms: 4-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-6,8-dimethyl-2H-chromen-2-one
Smiles: Cc1cc(C)c2c(c1)c(CN1CCN(CC1)c1ccccc1F)cc(=O)o2

STK597472
Synonyms: (3R)-5-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: O=C([C@@H]1CSC2N1C(=O)c1c2cccc1)NC1CC(C)(C)NC(C1)(C)C

STK597473
Synonyms: N'-acetyl-N'-[1-(2-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-4-methylbenzohydrazide
Smiles: Cc1ccc(cc1)C(=O)NN(C1CC(=O)N(C1=O)c1ccccc1Cl)C(=O)C

STK597478
Synonyms: N-(5-methyl-7-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-phenylacetamide
Smiles: O=C(Nc1nc2n(n1)C(CC(N2)C)c1ccccc1)Cc1ccccc1

STK597479
Synonyms: 2,6-dihydroxy-5-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)-3-(2-phenylethyl)pyrimidin-4(3H)-one
Smiles: O=C1OC(c2c1cccc2)c1c(O)nc(n(c1=O)CCc1ccccc1)O

STK852735
Synonyms: 1-(2,4-dihydroxyphenyl)-2-(2-ethoxyphenoxy)ethanone
Smiles: CCOc1ccccc1OCC(=O)c1ccc(cc1O)O

STK852737
Synonyms: 3-(4-chlorophenyl)-N-cyclohexyl-5-methylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(C)cc2NC1CCCCC1

STK852738
Synonyms: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-methylbenzyl)-4-oxo-4H-chromene-2-carboxamide
Smiles: Cc1ccc(cc1)CN(C(=O)c1cc(=O)c2c(o1)cccc2)C1CCS(=O)(=O)C1

STK597495
Synonyms: (5Z)-5-{[(2',6'-dihydroxy-3-methyl-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)amino]methylidene}-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CN1CCN2C(C1)C1(Cc3c2ccc(c3)N/C=C\2/C(=O)N=C(N(C2=O)C)S)C(=NC(=NC1=O)O)O

STK852739
Synonyms: ethyl4-hydroxy-2-(piperidin-1-yl)pyrimidine-5-carboxylate
Smiles: CCOC(=O)c1cnc(nc1O)N1CCCCC1

STK597504
Synonyms: (2E)-2-[2-(furan-2-ylcarbonyl)hydrazinylidene]-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-1-carboxylicacid
Smiles: O=C(c1ccco1)N/N=C\1/C(=O)C2(C(C1(CC2)C(=O)O)(C)C)C

STK597506
Synonyms: 5-benzyl-3-(5-chloro-2-hydroxy-4-methylphenyl)-4-(4-hydroxy-3-methoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1cc(ccc1O)C1N(Cc2ccccc2)C(=O)c2c1c([nH]n2)c1cc(Cl)c(cc1O)C

STK597507
Synonyms: (3S)-N-{(2S)-1-oxo-1-[(tetrahydrofuran-2-ylmethyl)amino]propan-2-yl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: O=C([C@@H](NC(=O)[C@H]1NCc2c(C1)cccc2)C)NCC1CCCO1

STK597509
Synonyms: 7-hydroxy-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1cnn2c1nc(C)cc2O

STK597510
Synonyms: 5-tert-butyl-7-{4-[2-(naphthalen-1-yloxy)ethyl]piperazin-1-yl}-3-phenylpyrazolo[1,5-a]pyrimidine
Smiles: CC(c1cc(N2CCN(CC2)CCOc2cccc3c2cccc3)n2c(n1)c(cn2)c1ccccc1)(C)C

STK597511
Synonyms: N-[2-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzyl]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)NCc1cc(ccc1C)c1nnc2n1nc(C)c1c2cccc1

STK597518
Synonyms: 8-(4-ethylpiperazin-1-yl)-6-hydroxy-3-methyl-7-(propan-2-yl)-3,7-dihydro-2H-purin-2-one
Smiles: CCN1CCN(CC1)c1nc2c(n1C(C)C)c(O)nc(=O)n2C

STK597520
Synonyms: 4-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5-(pyridin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Fc1cccc(c1/C=N/n1c(=S)[nH]nc1c1ccccn1)Cl

STK597524
Synonyms: 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-6-cyclopropyl-4-(trifluoromethyl)pyridine-3-carbonitrile
Smiles: N#Cc1c(SCc2nc3c([nH]2)cccc3)nc(cc1C(F)(F)F)C1CC1

STK852742
Synonyms: N-{4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl}-1-(3-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
Smiles: Cc1cccc(c1)n1ccc(=O)c(n1)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1cc(C)nc(n1)C

STK597528
Synonyms: 1-(4-fluorophenyl)-2-(2-phenylethyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: Fc1ccc(cc1)C1N(CCc2ccccc2)C(=O)c2c1c(=O)c1c(o2)cccc1

STK597529
Synonyms: 4-hydroxy-8-(4-methoxyphenyl)-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: COc1ccc(cc1)n1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK597530
Synonyms: 2-(2-hydroxyethyl)-1-(4-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: OCCN1C(=O)c2c(C1c1ccc(cc1)OC)c(=O)c1c(o2)cccc1

STK597533
Synonyms: 2-[(6-chloro-4-ethyl-2-oxo-2H-chromen-7-yl)oxy]-N-[3-(1H-imidazol-1-yl)propyl]acetamide
Smiles: CCc1cc(=O)oc2c1cc(Cl)c(c2)OCC(=O)NCCCn1cncc1

STK597536
Synonyms: 2-(4-methoxyphenyl)-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: COc1ccc(cc1)c1nn2c(n1)c1c(nc2)Oc2c(C1c1cccnc1)c(C)nn2c1ccccc1

STK852744
Synonyms: 5-[2-hydroxy-3-(1H-imidazol-1-yl)propyl]-3-methyl-1-oxo-1,5-dihydropyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: N#Cc1c(C)cc(=O)n2c1n(CC(Cn1cncc1)O)c1c2cccc1

STK597538
Synonyms: 4,6-dihydroxy-1-propylpyrimidin-2(1H)-one
Smiles: CCCn1c(O)cc(nc1=O)O

STK597541
Synonyms: (5Z)-3-(morpholin-4-yl)-5-[4-(prop-2-en-1-yloxy)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: C=CCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)N1CCOCC1

STK852746
Synonyms: 1-benzyl-N-cyclohexyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: O=c1c2cc(n(c2nc2n1cccc2)Cc1ccccc1)C(=O)NC1CCCCC1

STK597548
Synonyms: N-(2-fluorophenyl)-5-hydroxy-7,7-dimethyl-2-oxo-2,3,4,6,7,8-hexahydroquinoline-4-carboxamide
Smiles: O=C1N=C2CC(C)(C)CC(=C2C(C1)C(=O)Nc1ccccc1F)O

STK597555
Synonyms: 5-tert-butyl-N-(3,5-dichlorophenyl)-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Clc1cc(cc(c1)Cl)Nc1cc(nc2n1nc(c2c1ccccc1)C)C(C)(C)C

STK597557
Synonyms: 2-(1,3-benzoxazol-2-ylamino)-7,7-dimethyl-4-(pyridin-2-yl)-4,6,7,8-tetrahydroquinazolin-5-ol
Smiles: OC1=C2C(=NC(=NC2c2ccccn2)Nc2nc3c(o2)cccc3)CC(C1)(C)C

STK852750
Synonyms: N-[(2E)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2(3H)-ylidene]-2-oxo-2H-chromene-3-carboxamide
Smiles: CC1CCc2c(C1)s/c(=N/C(=O)c1cc3ccccc3oc1=O)/[nH]2

STK597563
Synonyms: 2-{2-[(4-methoxyphenoxy)methyl]-8,9-diphenyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl}ethanol
Smiles: OCCn1c(c2ccccc2)c(c2c1ncn1c2nc(n1)COc1ccc(cc1)OC)c1ccccc1

STK597564
Synonyms:
Smiles: CCC([C@@H](C(=O)OC)NC(=O)Nc1cc(ccc1C)c1n[nH]c(=O)c2c1cccc2)C

STK852752
Synonyms: 3-(4-chlorophenyl)-5-methyl-7-(pyrrolidin-1-yl)pyrazolo[1,5-a]pyrimidine
Smiles: Clc1ccc(cc1)c1cnn2c1nc(C)cc2N1CCCC1

STK597570
Synonyms: 1-{5-methyl-1-[6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]-1H-pyrazol-4-yl}ethanone
Smiles: CC(=O)c1cnn(c1C)c1ncnc(c1)N1CCN(CC1)c1ccccc1

STK852753
Synonyms: 2-[5-(3,4-dimethoxyphenyl)pyrimidin-4-yl]-5-[(2-methylprop-2-en-1-yl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1cncnc1c1ccc(cc1O)OCC(=C)C

STK597571
Synonyms: 4-methoxy-N-[(1S)-3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]benzamide
Smiles: CSCC[C@@H](c1nnc2n1cccc2)NC(=O)c1ccc(cc1)OC

STK597574
Synonyms: 4-imino-2-(3-methoxy-4-propoxyphenyl)-6,7-dihydro-4H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: CCCOc1ccc(cc1OC)c1cc2c3cc4OCOc4cc3CCn2c(=N)c1C#N

STK597576
Synonyms: 6,7-dimethoxy-N-(2-methoxyphenyl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Smiles: COc1cc2CN(CCc2cc1OC)C(=S)Nc1ccccc1OC

STK852755
Synonyms: 3-(2-hydroxyphenyl)-5-(3-hydroxypropyl)-4-(3,4,5-trimethoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: OCCCN1C(=O)c2c(C1c1cc(OC)c(c(c1)OC)OC)c([nH]n2)c1ccccc1O

STK852756
Synonyms: 3-(2-methoxyphenyl)-2,5-dimethyl-N-propylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CCCNc1cc(C)nc2n1nc(c2c1ccccc1OC)C

STK597581
Synonyms:
Smiles: CCC([C@@H](C(=O)OC)NC(=O)NCc1cccc(c1)OC)C

STK597583
Synonyms: 8-(2,4-dimethoxyphenyl)-4-hydroxy-1,7-dimethyl-1H-imidazo[2,1-f]purin-2(8H)-one
Smiles: COc1cc(OC)ccc1n1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK597589
Synonyms: 9-(4-hydroxy-3-methoxyphenyl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Smiles: CSc1nc2n(n1)C(c1ccc(c(c1)OC)O)C1=C(O)CCCC1=N2

STK597592
Synonyms: 6-cyclohexyl-1-(4-fluorophenyl)-2-hydroxy-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: Fc1ccc(cc1)n1c(O)nc(=O)c2c1NCN(C2)C1CCCCC1

STK597594
Synonyms: N-[(thiophen-2-ylmethyl)carbamoyl]-L-valine
Smiles: O=C(N[C@H](C(=O)O)C(C)C)NCc1cccs1

STK597597
Synonyms: N-{[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}-3,4-dimethoxybenzamide
Smiles: COc1cc(ccc1OC)C(=O)NCc1nnc2n1cc(Cl)cc2C(F)(F)F

STK597600
Synonyms: 7-hydroxy-5-(4-hydroxyphenyl)-2-methyl-5,6-dihydropyrido[2,3-d]pyrimidin-4(3H)-one
Smiles: Oc1ccc(cc1)C1CC(=Nc2c1c(=O)[nH]c(n2)C)O

STK597601
Synonyms: [(benzylamino)(2-hydroxyphenyl)methyl]phosphinicacid
Smiles: OP(=O)C(c1ccccc1O)NCc1ccccc1

STK597604
Synonyms: (3Z)-3-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)-1,1-diphenylpropan-2-one
Smiles: O=C(C(c1ccccc1)c1ccccc1)/C=C/1\NCCc2c1cc1OCOc1c2

STK852759
Synonyms: 8,10-dimethyl-N-(propan-2-yl)-2-propylpyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-4-amine
Smiles: CCCc1cc(NC(C)C)n2c(n1)c1c(C)cc(nc1n2)C

STK597609
Synonyms: N-[5-hydroxy-2-(phenoxymethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-2-phenylbutanamide
Smiles: CCC(C(=O)Nc1cc(O)nc2n1nc(n2)COc1ccccc1)c1ccccc1

STK852760
Synonyms: 4-(3,4-dimethoxyphenyl)-1-phenyl-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione
Smiles: COc1ccc(cc1OC)C1CC(=O)N(C2=C1C(=O)OC2)c1ccccc1

STK597612
Synonyms: 3-(2,3-dimethylphenyl)-6-hydroxy-1',6'-dimethyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Smiles: Cc1ccc2c(c1)CC1(CN2C)C(=NC(=O)N(C1=O)c1cccc(c1C)C)O

STK852763
Synonyms: 2-methyl-N-[(2Z)-6-(methylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]pentanamide
Smiles: CCCC(C(=O)/N=c/1\sc2c([nH]1)ccc(c2)S(=O)(=O)C)C

STK597619
Synonyms: {[6-cyano-8,8-dimethyl-5-(phenylamino)-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl}aceticacid
Smiles: N#Cc1c(Nc2ccccc2)n2c(SCC(=O)O)nnc2c2c1CC(C)(C)OC2

STK597620
Synonyms: N-(3,4-dimethoxybenzyl)-5-fluoro-N-(furan-2-ylmethyl)-1H-indole-2-carboxamide
Smiles: COc1ccc(cc1OC)CN(C(=O)c1[nH]c2c(c1)cc(cc2)F)Cc1ccco1

STK597623
Synonyms: 2-[2-amino-5-(2-bromophenoxy)pyrimidin-4-yl]-5-[(2-chloro-6-fluorobenzyl)oxy]phenol
Smiles: Nc1ncc(c(n1)c1ccc(cc1O)OCc1c(F)cccc1Cl)Oc1ccccc1Br

STK597626
Synonyms: N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(2-hydroxy-4-methylphenyl)-1H-pyrazole-3-carboxamide
Smiles: Cc1ccc(c(c1)O)c1[nH]nc(c1)C(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C

STK597631
Synonyms: 4-oxo-N-{3-[(2-phenylethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-4H-chromene-2-carboxamide
Smiles: O=C(c1c(sc2c1CCCC2)NC(=O)c1cc(=O)c2c(o1)cccc2)NCCc1ccccc1

STK852765
Synonyms: 3-(2,4-dimethoxyphenyl)-6-oxo-8-(2,4,5-trimethoxyphenyl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: COc1ccc(c(c1)OC)N1CSC2=C(C#N)C(CC(=O)N2C1)c1cc(OC)c(cc1OC)OC

STK852766
Synonyms: (2E)-3-[(5-fluoro-2-methylphenyl)amino]-2-[4-(naphthalen-1-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cc(F)ccc1C)/c1scc(n1)c1cccc2c1cccc2

STK597634
Synonyms: 4-(3,4-dichlorophenyl)-3-(2-hydroxy-3,5-dimethylphenyl)-5-[2-(4-methoxyphenyl)ethyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1ccc(c(c1)Cl)Cl)c([nH]n2)c1cc(C)cc(c1O)C

STK852767
Synonyms: propan-2-ylN-{[1-(3-methoxypropyl)-9-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidin-2-yl]carbonyl}glycinate
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCC(=O)OC(C)C

STK597640
Synonyms: 2-[(2E)-2-(hydroxyimino)cyclohexyl]pyridine-4-carboxylicacid
Smiles: O/N=C/1\CCCCC1c1nccc(c1)C(=O)O

STK852768
Synonyms: 5-(4-fluorobenzyl)-3-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: Oc1ccc(cc1)C1N(Cc2ccc(cc2)F)C(=O)c2c1c([nH]n2)c1ccccc1O

STK597641
Synonyms: (5Z)-3-(morpholin-4-yl)-5-[4-(octyloxy)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)N1CCOCC1

STK597644
Synonyms: 12-(furan-2-yl)-2-(phenoxymethyl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
Smiles: Oc1ccc2c(c1)Oc1c(C2c2ccco2)c2nc(nn2cn1)COc1ccccc1

STK597650
Synonyms: N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)c1cc2c(n1C)ccc(c2)F

STK597652
Synonyms: 8-hydroxy-3,3,6,6-tetramethyl-9-(2-nitrophenyl)-3,4,5,6,7,9-hexahydroacridin-1(2H)-one
Smiles: OC1=C2C(=NC3=C(C2c2ccccc2[N+](=O)[O-])C(=O)CC(C3)(C)C)CC(C1)(C)C

STK597653
Synonyms: ethyl6'-amino-5-chloro-3'-methyl-2-oxo-1'-phenyl-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C31C(=O)Nc1c3cc(Cl)cc1)c(C)nn2c1ccccc1

STK597654
Synonyms: 8-[(2Z)-2-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)hydrazinyl]-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)OCC(Cn1c(N/N=C\2/C(=NC(=NC2=O)O)O)nc2c1c(=O)n(C)c(=O)n2C)O

STK597655
Synonyms: N-{[6-chloro-8-(trifluoromethyl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}-2,2-dimethylpropanamide
Smiles: Clc1cc(c2n(c1)c(CNC(=O)C(C)(C)C)nn2)C(F)(F)F

STK597656
Synonyms: 5-[1-(chloroacetyl)-5-(4-methoxyphenyl)pyrazolidin-3-ylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: ClCC(=O)N1NC(=C2C(=O)N(C)C(=O)N(C2=O)C)CC1c1ccc(cc1)OC

STK597658
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-3,5-diphenylpyrazolo[1,5-a]pyrimidin-7-amine
Smiles: COc1cc(CCNc2cc(nc3n2ncc3c2ccccc2)c2ccccc2)ccc1OC

STK852771
Synonyms: ethyl4-{[5-(4-ethoxy-2-hydroxyphenyl)-3-methyl-1H-pyrazol-4-yl]oxy}benzoate
Smiles: CCOc1ccc(c(c1)O)c1[nH]nc(c1Oc1ccc(cc1)C(=O)OCC)C

STL036567
Synonyms: 1'-tert-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: OC1=NC(=O)C2(C(=O)N1C(C)(C)C)Cc1cc(ccc1N1C2CCCCC1)[N+](=O)[O-]

STK597667
Synonyms: 2-hydroxy-4-[({4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl}carbonyl)amino]benzoicacid
Smiles: S=C1S/C(=C\c2ccc(cc2)C(=O)Nc2ccc(c(c2)O)C(=O)O)/C(=O)N1C

STK597669
Synonyms: 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one
Smiles: CC([C@H](n1nnc2c(c1=O)cccc2)C(=O)N1CCOCC1)C

STK597670
Synonyms: (5Z)-3-(furan-2-ylmethyl)-5-({3-[2-methyl-4-(propan-2-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CC(Oc1ccc(c(c1)C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)Cc1ccco1)c1ccccc1)C

STK597674
Synonyms: 2-[4-(3,4-dimethoxyphenyl)-1H-pyrazol-5-yl]-5-[(4-methylbenzyl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1cn[nH]c1c1ccc(cc1O)OCc1ccc(cc1)C

STK597678
Synonyms: (2E)-3-(2,4-dichlorophenyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-methoxybenzyl)prop-2-enamide
Smiles: COc1ccc(cc1)CN(C1CCS(=O)(=O)C1)C(=O)/C=C/c1ccc(cc1Cl)Cl

STK852777
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-7-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: Cc1ccc2n(c1)c(=O)c1c(n2)n(c(c1)C(=O)NCc1ccc2c(c1)OCO2)Cc1ccccc1

STK852778
Synonyms: 5-methyl-2-(phenoxymethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(3H)-one
Smiles: Cc1cc(=O)n2c(n1)[nH]c(n2)COc1ccccc1

STK852779
Synonyms: 1-(3-methylphenyl)-4-oxo-N-[4-(piperidin-1-ylsulfonyl)phenyl]-1,4-dihydropyridazine-3-carboxamide
Smiles: Cc1cccc(c1)n1ccc(=O)c(n1)C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCCC1

STK852780
Synonyms: 4-butyl-N-[4-(3,4-dimethoxyphenyl)-1,2,5-oxadiazol-3-yl]cyclohexanecarboxamide
Smiles: CCCCC1CCC(CC1)C(=O)Nc1nonc1c1ccc(c(c1)OC)OC

STK597686
Synonyms: 6-hydroxy-5-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
Smiles: COc1cc(/C=C/C(=O)c2c(O)n(C)c(=O)n(c2=O)C)cc(c1O)OC

STK597687
Synonyms: 4-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl}-6,7,8,9-tetrahydro-2H-benzo[g]chromen-2-one
Smiles: O=c1cc(CN2CCN(CC2)Cc2ccc3c(c2)OCO3)c2c(o1)cc1c(c2)CCCC1

STK852782
Synonyms: 7-[4-(2-fluorophenyl)piperazin-1-yl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine
Smiles: Cc1nc2ncnn2c(c1)N1CCN(CC1)c1ccccc1F

STK597693
Synonyms: 6-hydroxy-3-methyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-2H-purin-2-one
Smiles: Oc1nc(=O)n(c2c1[nH]c(n2)CN1CCOCC1)C

STK597695
Synonyms: 1-(4-chlorophenyl)-2-(3-hydroxypropyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: OCCCN1C(=O)c2c(C1c1ccc(cc1)Cl)c(=O)c1c(o2)cccc1

STK852783
Synonyms: N-(4-fluorophenyl)-2-methyl-3-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrazolo[1,5-a]pyrimidin-8-amine
Smiles: Fc1ccc(cc1)Nc1c2CCCc2nc2n1nc(c2c1ccccc1)C

STK597701
Synonyms: 5-[(4-bromobenzyl)oxy]-2-[4-(4-methoxyphenyl)-3-methyl-1H-pyrazol-5-yl]phenol
Smiles: COc1ccc(cc1)c1c(C)n[nH]c1c1ccc(cc1O)OCc1ccc(cc1)Br

STK597703
Synonyms: N,3,6,6-tetramethyl-N-(1-methylpiperidin-4-yl)-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide
Smiles: CN1CCC(CC1)N(C(=O)c1oc2c(c1C)C(=O)CC(C2)(C)C)C

STK597707
Synonyms: ethyl1-[(5,6-dimethoxy-1H-indol-2-yl)carbonyl]piperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)C(=O)c1cc2c([nH]1)cc(c(c2)OC)OC

STK597708
Synonyms: 2-(4-fluorophenyl)-12-(4-methoxyphenyl)-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Smiles: COc1ccc(cc1)C1C2=C(CCCC2=O)Oc2c1c1nc(nn1cn2)c1ccc(cc1)F

STK597711
Synonyms: N-(5-hydroxy-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)Nc1cc(O)nc2n1nc(n2)c1ccccc1

STK597712
Synonyms: [(5S)-5-(benzylcarbamoyl)-3-(2,5-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]aceticacid
Smiles: COc1ccc(c(c1)C1=NO[C@@](C1)(CC(=O)O)C(=O)NCc1ccccc1)OC

STK597714
Synonyms: [4-(2-methoxyphenyl)piperazin-1-yl](4,5,6-trimethoxy-1H-indol-2-yl)methanone
Smiles: COc1ccccc1N1CCN(CC1)C(=O)c1cc2c([nH]1)cc(c(c2OC)OC)OC

STK597716
Synonyms: 3-benzyl-4-hydroxypyrimido[1,2-a]benzimidazol-2(1H)-one
Smiles: O=c1[nH]c2nc3c(n2c(c1Cc1ccccc1)O)cccc3

STK597718
Synonyms: (2S)-N-[4-(dimethylamino)phenyl]-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Smiles: O=C([C@@H](n1nnc2c(c1=O)cccc2)C)Nc1ccc(cc1)N(C)C

STK597720
Synonyms: (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(2-fluorophenyl)amino]methylidene}-2-hydroxypyrimidine-4,6(1H,5H)-dione
Smiles: OC1=NC(=O)/C(=C/Nc2ccccc2F)/C(=O)N1CCC1=CCCCC1

STK597725
Synonyms: N-[(9-oxo-9H-fluoren-4-yl)carbonyl]-L-alanine
Smiles: OC(=O)[C@@H](NC(=O)c1cccc2c1c1ccccc1C2=O)C

STK597727
Synonyms: N-[4-(4-acetylpiperazin-1-yl)phenyl]-5-fluoro-1H-indole-2-carboxamide
Smiles: Fc1ccc2c(c1)cc([nH]2)C(=O)Nc1ccc(cc1)N1CCN(CC1)C(=O)C

STK597728
Synonyms: 7,7-dimethyl-2-phenyl-4-[(2-phenylethyl)sulfanyl]-7,8-dihydro-5H-pyrano[4,3-d]pyrimidine
Smiles: CC1(C)OCc2c(C1)nc(nc2SCCc1ccccc1)c1ccccc1

STK597731
Synonyms: 2-(2-amino-5-phenylpyrimidin-4-yl)-5-[(2,4-dichlorobenzyl)oxy]phenol
Smiles: Clc1ccc(c(c1)Cl)COc1ccc(c(c1)O)c1nc(N)ncc1c1ccccc1

STK597737
Synonyms: (4Z)-6-{[4-(3-methoxyphenyl)piperazin-1-yl]methyl}-4-(phenylimino)-4,5-dihydro-1,3,5-triazin-2-amine
Smiles: COc1cccc(c1)N1CCN(CC1)Cc1nc(N)n/c(=N\c2ccccc2)/[nH]1

STK597744
Synonyms: (6-methoxy-1H-indol-2-yl)[4-(2-methoxyphenyl)piperazin-1-yl]methanone
Smiles: COc1ccc2c(c1)[nH]c(c2)C(=O)N1CCN(CC1)c1ccccc1OC

STK597749
Synonyms: tert-butyl(3S)-3-({2-[(4-methylbenzyl)amino]-2-oxoethyl}carbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: O=C(NCc1ccc(cc1)C)CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK597750
Synonyms: methylN-[(4-sulfamoylphenyl)carbamoyl]-L-alaninate
Smiles: COC(=O)[C@@H](NC(=O)Nc1ccc(cc1)S(=O)(=O)N)C

STK597754
Synonyms: 1-{[4-(diphenylmethyl)piperazin-1-yl]methyl}-3H-benzo[f]chromen-3-one
Smiles: O=c1cc(CN2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(o1)ccc1c2cccc1

STK852796
Synonyms: 3-chloro-4-(dibenzylamino)-1-phenyl-1H-pyrrole-2,5-dione
Smiles: ClC1=C(N(Cc2ccccc2)Cc2ccccc2)C(=O)N(C1=O)c1ccccc1

STK597759
Synonyms: 7-hydroxy-2-methyl-5-(2,3,4-trimethoxyphenyl)-5,6-dihydropyrido[2,3-d]pyrimidin-4(3H)-one
Smiles: COc1c(ccc(c1OC)OC)C1CC(=Nc2c1c(=O)[nH]c(n2)C)O

STK852797
Synonyms: (2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yldiethylcarbamate
Smiles: CCN(C(=O)Oc1ccc2c(c1)O/C(=C\c1ccc3c(c1)OCO3)/C2=O)CC

STK597761
Synonyms: 5-(5-chloro-2-hydroxyphenyl)-N-(3-chloro-4-methylphenyl)-1H-pyrazole-3-carboxamide
Smiles: Clc1ccc(c(c1)c1[nH]nc(c1)C(=O)Nc1ccc(c(c1)Cl)C)O

STK597765
Synonyms: 3-(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)-1-(naphthalen-1-yl)pyrrolidine-2,5-dione
Smiles: COc1cc2c(cc1OC)CCN(C2C)C1CC(=O)N(C1=O)c1cccc2c1cccc2

STK597767
Synonyms: (4E)-2-(3-chlorophenyl)-4-{[(1,1-dioxidotetrahydrothiophen-3-yl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: Clc1cccc(c1)N1C(=O)/C(=C/NC2CCS(=O)(=O)C2)/c2c(C1=O)cccc2

STK852799
Synonyms: 2-ethyl-10-methyl-3-(2-phenylethyl)pyrimido[4,5-b]quinoline-4,5(3H,10H)-dione
Smiles: CCc1nc2c(c(=O)n1CCc1ccccc1)c(=O)c1c(n2C)cccc1

STK597777
Synonyms: 1-amino-N,N-diethyl-5-(piperidin-1-yl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
Smiles: CCN(C(=O)c1sc2c(c1N)c1CCCCc1c(n2)N1CCCCC1)CC

STK597778
Synonyms: N-(3-chloro-2-methylphenyl)-5-hydroxy-2-oxo-2,3,4,6,7,8-hexahydroquinoline-4-carboxamide
Smiles: O=C1N=C2CCCC(=C2C(C1)C(=O)Nc1cccc(c1C)Cl)O

STK597782
Synonyms: N-{7-[2-hydroxy-3-(4-methylphenoxy)propyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}-beta-alanine
Smiles: OC(=O)CCNc1nc2c(n1CC(COc1ccc(cc1)C)O)c(=O)n(c(=O)n2C)C

STK597789
Synonyms: (4E)-2-(2,4-dimethoxyphenyl)-4-{[(2-hydroxyethyl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Smiles: OCCN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(cc1OC)OC

STK597792
Synonyms: 4-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-7,8-dihydrocyclopenta[g]chromen-2(6H)-one
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1cc(=O)oc2c1cc1CCCc1c2

STK597794
Synonyms: N-[(5E)-5-(3,4-dihydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-3-hydroxybenzamide
Smiles: Oc1cccc(c1)C(=O)NN1C(=S)S/C(=C/c2ccc(c(c2)O)O)/C1=O

STK597795
Synonyms: 4-[(7-chloro-2-methoxybenzo[b][1,5]naphthyridin-10-yl)amino]-2,6-bis(pyrrolidin-1-ylmethyl)phenol
Smiles: COc1ccc2c(n1)c(Nc1cc(CN3CCCC3)c(c(c1)CN1CCCC1)O)c1c(n2)cc(cc1)Cl

STK597796
Synonyms: 3-(4-methoxyphenyl)-2-[(pyridin-4-ylmethyl)amino]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: COc1ccc(cc1)n1c(NCc2ccncc2)nc2c(c1=O)c1CCCCCc1s2

STK852802
Synonyms: 5-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-fluorophenyl)-3-(2-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1ccc(cc1OC)CCN1C(=O)c2c(C1c1ccc(cc1)F)c([nH]n2)c1ccccc1O

STK852803
Synonyms: 2-[(4-methoxyphenoxy)methyl]-8,9-dimethylfuro[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccc(cc1)OCc1nn2c(n1)c1c(nc2)oc(c1C)C

STK597800
Synonyms: N-(4-bromophenyl)-2-[(1-hydroxy-5-methyl-9-oxo-9H-xanthen-3-yl)oxy]acetamide
Smiles: O=C(Nc1ccc(cc1)Br)COc1cc(O)c2c(c1)oc1c(c2=O)cccc1C

STK597803
Synonyms: 3-(5-chloro-2-hydroxy-4-methylphenyl)-4-(2-fluorophenyl)-5-(3-hydroxypropyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: OCCCN1C(=O)c2c(C1c1ccccc1F)c([nH]n2)c1cc(Cl)c(cc1O)C

STK852806
Synonyms: 3-(2,5-dimethoxyphenyl)-4-methyl-2-oxo-2H-chromen-6-ylmorpholine-4-carboxylate
Smiles: COc1ccc(cc1c1c(=O)oc2c(c1C)cc(cc2)OC(=O)N1CCOCC1)OC

STK852807
Synonyms: 5,6-dimethyl-3-(2-phenylethyl)thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: Cc1c(C)sc2c1c(=O)n(cn2)CCc1ccccc1

STK597812
Synonyms: 4-chloro-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-(2-methylpropyl)benzamide
Smiles: CC(CN(C(=O)c1ccc(cc1)Cl)Cc1cc2cc(C)ccc2[nH]c1=O)C

STK852808
Synonyms: 5-methyl-3-phenyl-N-(pyridin-2-ylmethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: Cc1cc(NCc2ccccn2)n2c(n1)c(c1ccccc1)c(n2)C(F)(F)F

STK597818
Synonyms: N-[(4-oxoquinazolin-3(4H)-yl)acetyl]glycine
Smiles: O=C(Cn1cnc2c(c1=O)cccc2)NCC(=O)O

STK597820
Synonyms: N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]-1-benzofuran-2-carboxamide
Smiles: O=C(c1cc2c(o1)cccc2)NCCc1nnc2n1cccc2

STK597824
Synonyms: 5-benzyl-4-hydroxy-6-methyl-2-phenyl-1,2-dihydro-3H-pyrazolo[3,4-b]pyridin-3-one
Smiles: Cc1nc2[nH]n(c(=O)c2c(c1Cc1ccccc1)O)c1ccccc1

STK597826
Synonyms: 3-(5-chloro-2-hydroxy-4-methylphenyl)-5-(2-hydroxyethyl)-4-(3,4,5-trimethoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: OCCN1C(=O)c2c(C1c1cc(OC)c(c(c1)OC)OC)c([nH]n2)c1cc(Cl)c(cc1O)C

STK852810
Synonyms: [3-(benzylamino)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl](4-chlorophenyl)methanone
Smiles: Clc1ccc(cc1)C(=O)n1c(NCc2ccccc2)n[nH]c1=S

STK852814
Synonyms: 2-[7-(3,5-dimethylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]-5-methoxyphenol
Smiles: COc1ccc(c(c1)O)c1nn2c(n1)c1cnn(c1nc2)c1cc(C)cc(c1)C

STK852815
Synonyms: (2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-7-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-ylmorpholine-4-carboxylate
Smiles: O=C(N1CCOCC1)Oc1ccc2c(c1C)O/C(=C\c1ccc3c(c1)OCO3)/C2=O

STK597837
Synonyms: (2E,5Z)-2-[(4-hydroxyphenyl)imino]-5-[(1-methyl-1H-indol-3-yl)methylidene]-2,5-dihydro-1,3-thiazol-4-ol
Smiles: Oc1ccc(cc1)/N=C\1/S/C(=C\c2cn(c3c2cccc3)C)/C(=N1)O

STK597841
Synonyms: 5-(2-hydroxyphenyl)-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]-1H-pyrazole-3-carboxamide
Smiles: O=C(c1n[nH]c(c1)c1ccccc1O)Nc1nc2c(s1)cc(cc2)S(=O)(=O)C

STK852817
Synonyms: 2-[4-(3,5-diphenylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]ethanol
Smiles: OCCN1CCN(CC1)c1cc(nc2n1ncc2c1ccccc1)c1ccccc1

STK597845
Synonyms: (5E)-6-hydroxy-3-(4-methoxyphenyl)-5-(1-{[2-(morpholin-4-yl)ethyl]amino}propylidene)pyrimidine-2,4(3H,5H)-dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)OC)O)/NCCN1CCOCC1

STK597847
Synonyms: 6-amino-1-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxypyrimidin-4(1H)-one
Smiles: Fc1ccc2c(c1)c(c[nH]2)CCn1c(N)cc(=O)nc1O

STK852818
Synonyms: methyl5-amino-6-cyano-2-methyl-7-(thiophen-3-yl)-7H-thieno[3,2-b]pyran-3-carboxylate
Smiles: COC(=O)c1c(C)sc2c1OC(=C(C2c1cscc1)C#N)N

STK852819
Synonyms: 5-(benzyloxy)-2-[5-(4-methoxyphenoxy)pyrimidin-4-yl]phenol
Smiles: COc1ccc(cc1)Oc1cncnc1c1ccc(cc1O)OCc1ccccc1

STK597851
Synonyms: methylN-{[4-(diphenylmethyl)piperazin-1-yl]carbonyl}-L-valinate
Smiles: COC(=O)[C@H](C(C)C)NC(=O)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK852820
Synonyms: 1-(3-methoxypropyl)-9-methyl-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)NCc1ccccn1

STK597860
Synonyms: 7'-{[(E)-(1-butyl-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]amino}-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
Smiles: CCCCN1C(=O)N=C(/C(=C\Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK852821
Synonyms: 5-methyl-3-(4-methylphenyl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine
Smiles: CC(CNc1cc(C)nc2n1ncc2c1ccc(cc1)C)C

STK597862
Synonyms: 5-(2-hydroxy-4,6-dimethylphenyl)-N-[3-(trifluoromethyl)phenyl]-1H-pyrazole-3-carboxamide
Smiles: Cc1cc(C)c(c(c1)O)c1[nH]nc(c1)C(=O)Nc1cccc(c1)C(F)(F)F

STK597863
Synonyms: 7-(ethylsulfanyl)-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidine
Smiles: CCSc1nnc2n1c1sc3c(c1c1n2ncn1)CCCC3

STK597866
Synonyms: (2E)-2-[4-(6-chloro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-(2-chloroquinolin-3-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cc2ccccc2nc1Cl)/c1scc(n1)c1cc2cc(Cl)ccc2oc1=O

STK597871
Synonyms: 8-[benzyl(methyl)amino]-1-(2-fluorobenzyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccccc1Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)N(Cc1ccccc1)C

STK597874
Synonyms: methylN-(cyclohexylcarbamoyl)-L-phenylalaninate
Smiles: COC(=O)[C@H](Cc1ccccc1)NC(=O)NC1CCCCC1

STK597875
Synonyms: 6-chloro-N-(4-ethoxy-2-nitrophenyl)-7-methyl-4-oxo-4H-chromene-2-carboxamide
Smiles: CCOc1ccc(c(c1)[N+](=O)[O-])NC(=O)c1cc(=O)c2c(o1)cc(c(c2)Cl)C

STK597876
Synonyms: 4-(acetylamino)-N-[(1S)-3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]benzamide
Smiles: CSCC[C@@H](c1nnc2n1cccc2)NC(=O)c1ccc(cc1)NC(=O)C

STK597880
Synonyms: 8-(butan-2-ylamino)-6-hydroxy-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-2H-purin-2-one
Smiles: CCC(Nc1nc2c(n1CCCc1ccccc1)c(O)nc(=O)n2C)C

STK597882
Synonyms: ethyl1-[(4,5,6-trimethoxy-1H-indol-2-yl)carbonyl]piperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)C(=O)c1cc2c([nH]1)cc(c(c2OC)OC)OC

STK597884
Synonyms: (5E)-3-(2-methoxyethyl)-5-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: COCCN1C(=S)S/C(=C/c2ccc3c(c2)CC(O3)C)/C1=O

STK597885
Synonyms: 2-methyl-14-(pyridin-3-yl)-14H-benzo[7,8]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1nn2c(n1)c1c(nc2)Oc2c(C1c1cccnc1)ccc1c2cccc1

STK852826
Synonyms: 5-benzyl-2,3-diphenylpyrazolo[1,5-a]pyrimidin-7-ol
Smiles: Oc1cc(Cc2ccccc2)nc2n1nc(c2c1ccccc1)c1ccccc1

STK597892
Synonyms: 8-[(2-fluorophenyl)sulfonyl]-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: Fc1ccccc1S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1

STK597897
Synonyms: 7-benzyl-5,6-dimethyl-N-(pyridin-3-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Smiles: Cc1n(Cc2ccccc2)c2c(c1C)c(ncn2)Nc1cccnc1

STK597899
Synonyms: 2-[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-1-yl)oxy]-N-(pyridin-4-ylmethyl)propanamide
Smiles: O=C(C(Oc1cc(C)cc2c1c1CCCCc1c(=O)o2)C)NCc1ccncc1

STK597903
Synonyms: 2-[(5Z)-5-(2-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-N-methylacetamide
Smiles: Oc1ccc(cc1)C(CN(C(=O)CN1C(=S)S/C(=C\c2ccccc2F)/C1=O)C)O

STK597905
Synonyms: N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-leucine
Smiles: CC(C[C@@H](C(=O)O)NC(=O)c1cc2c(n1C)ccc(c2)F)C

STK597906
Synonyms: 7-ethoxy-3-(2-ethoxyphenoxy)-2-methyl-4H-chromen-4-one
Smiles: CCOc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1OCC)C

STK597909
Synonyms: 4-[(4-benzylpiperidinium-1-yl)methyl]-2-oxo-2H-chromen-6-olate
Smiles: [O-]c1ccc2c(c1)c(C[NH+]1CCC(CC1)Cc1ccccc1)cc(=O)o2

STK852828
Synonyms: 2-chloro-N-(2-methoxyethyl)-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Smiles: COCCN(C(=O)c1ccccc1Cl)Cc1cc2cccc(c2[nH]c1=O)C

STK597921
Synonyms: 7-hydroxy-2-methyl-3,5-diphenylpyrazolo[1,5-a]pyrimidine-6-carbonitrile
Smiles: N#Cc1c(nc2n(c1O)nc(c2c1ccccc1)C)c1ccccc1

STK597922
Synonyms: 7-cyclohexyl-N~5~-[2-(dimethylamino)ethyl]-6,7,8,9-tetrahydro-3H-pyrazolo[3,4-c][2,7]naphthyridine-1,5-diamine
Smiles: CN(CCNc1nc2[nH]nc(c2c2c1CN(CC2)C1CCCCC1)N)C

STK597924
Synonyms: 7'-({(E)-[4-hydroxy-2,6-dioxo-1-(prop-2-en-1-yl)-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}amino)-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H
Smiles: C=CCN1C(=O)N=C(/C(=C\Nc2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK597925
Synonyms: ethyl1-[(5-chloro-1H-indol-2-yl)carbonyl]piperidine-3-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)C(=O)c1cc2c([nH]1)ccc(c2)Cl

STK852829
Synonyms: 3-benzyl-8-(4-chlorophenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)Cl)Cc1ccccc1

STK852830
Synonyms: (2Z)-2-(2-ethoxybenzylidene)-6-(2-oxopropoxy)-1-benzofuran-3(2H)-one
Smiles: CCOc1ccccc1/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)C

STK597932
Synonyms:
Smiles: CCC([C@@H](C(=O)N/N=C/c1cc2ccc(cc2nc1Cl)C)N)C

STK597934
Synonyms: (5E)-5-(3,4-dihydroxybenzylidene)-3-[2-(4-methoxyphenyl)ethyl]-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1)CCN1C(=S)S/C(=C/c2ccc(c(c2)O)O)/C1=O

STK597936
Synonyms: (1S,2S)-2-phenyl-N'-[(E)-quinolin-8-ylmethylidene]cyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1cccc2c1nccc2

STK597937
Synonyms: 3-(furan-2-yl)-N-(furan-2-ylmethyl)-6-methylheptan-1-amine
Smiles: CC(CCC(c1ccco1)CCNCc1ccco1)C

STK597938
Synonyms: 5-(2-hydroxy-4,5-dimethylphenyl)-N-{4-[(4-methylpiperidin-1-yl)sulfonyl]phenyl}-1H-pyrazole-3-carboxamide
Smiles: CC1CCN(CC1)S(=O)(=O)c1ccc(cc1)NC(=O)c1n[nH]c(c1)c1cc(C)c(cc1O)C

STK597942
Synonyms: 7-chloro-1-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-(4-methylbenzyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: COc1cc(ccc1O)C1N(Cc2ccc(cc2)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK597949
Synonyms: 3-cyclopentyl-N-[(2Z)-5,5-dioxido-3-(prop-2-en-1-yl)tetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]propanamide
Smiles: C=CCN1/C(=N/C(=O)CCC2CCCC2)/SC2C1CS(=O)(=O)C2

STK852835
Synonyms: N,N-dimethyl-N'-(2-methyl-3-phenyl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)benzene-1,4-diamine
Smiles: Cc1nn2c(c1c1ccccc1)nc1c(c2Nc2ccc(cc2)N(C)C)CCCC1

STK597956
Synonyms: N-[(4Z)-3-oxo-4-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)butyl]benzamide
Smiles: O=C(/C=C/1\NCCc2c1cc1OCCCOc1c2)CCNC(=O)c1ccccc1

STK597958
Synonyms: 3-(1H-benzimidazol-2-yl)-1-(2,3-dihydro-1H-indol-1-yl)propan-1-one
Smiles: O=C(N1CCc2c1cccc2)CCc1nc2c([nH]1)cccc2

STK852837
Synonyms: 8-(4-methoxybenzyl)-1,3,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(cc1)Cn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)C

STK597960
Synonyms: 4-amino-6-[(4-methylphenyl)amino]-1,3,5-triazin-2-ol
Smiles: Cc1ccc(cc1)Nc1nc(N)nc(n1)O

STK597962
Synonyms: 1-{5-methyl-1-[2-methyl-6-(4-propylphenoxy)pyrimidin-4-yl]-1H-pyrazol-4-yl}ethanone
Smiles: CCCc1ccc(cc1)Oc1nc(C)nc(c1)n1ncc(c1C)C(=O)C

STK597964
Synonyms: 4-(4-methoxyphenyl)-3-methyl-6-[2-(morpholin-4-yl)ethyl]-1-phenyl-4,6-dihydropyrazolo[4',3':5,6]pyrano[2,3-d]pyrimidin-5(1H)-imine
Smiles: COc1ccc(cc1)C1c2c(ncn(c2=N)CCN2CCOCC2)Oc2c1c(C)nn2c1ccccc1

STK597969
Synonyms: (2R)-2-amino-N'-[(E)-(2-chloro-7-methylquinolin-3-yl)methylidene]-3-methylbutanehydrazide(non-preferredname)
Smiles: CC([C@H](C(=O)N/N=C/c1cc2ccc(cc2nc1Cl)C)N)C

STK852840
Synonyms: 3-(2-methoxyphenyl)-6-oxo-8-(2,4,5-trimethoxyphenyl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1cc(OC)c(cc1OC)OC)c1ccccc1OC

STK597975
Synonyms: 1-(4-chlorophenyl)-2-[4-(dimethylamino)phenyl]-N-(2-methylphenyl)-4-oxoazetidine-2-carboxamide
Smiles: Clc1ccc(cc1)N1C(=O)CC1(c1ccc(cc1)N(C)C)C(=O)Nc1ccccc1C

STK852841
Synonyms: N-(4-ethylphenyl)-1-(3-methoxypropyl)-9-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)Nc1ccc(cc1)CC

STK852842
Synonyms: 1-benzyl-N-cyclohexyl-7-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: Cc1ccc2n(c1)c(=O)c1c(n2)n(c(c1)C(=O)NC1CCCCC1)Cc1ccccc1

STK597986
Synonyms: 2-(benzylsulfanyl)-5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: Cc1nc2nc(nn2c(c1C)O)SCc1ccccc1

STK597987
Synonyms: N-(3-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide
Smiles: CCOc1ccccc1C(=O)N(C1CCS(=O)(=O)C1)Cc1cccc(c1)Cl

STK597988
Synonyms: (4E)-2-(2,3-dichlorophenyl)-4-({[3-(morpholin-4-yl)propyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: O=C1/C(=C/NCCCN2CCOCC2)/c2ccccc2C(=O)N1c1cccc(c1Cl)Cl

STK597989
Synonyms: 2-({4-amino-5-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4-difluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1F)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK852845
Synonyms: methyl[(4E)-2-oxo-4-(phenylimino)-1,3-thiazolidin-5-yl]acetate
Smiles: COC(=O)CC1SC(=O)N/C/1=N/c1ccccc1

STK597992
Synonyms: 9-methyl-4-(trifluoromethyl)thieno[2,3-b:4,5-b']dipyridine-2,7-diol
Smiles: Oc1cc(C)c2c(n1)sc1c2nc(cc1C(F)(F)F)O

STK852848
Synonyms: 6-{[(4-methylphenyl)sulfanyl]methyl}-2-(morpholin-4-yl)pyrimidin-4-ol
Smiles: Cc1ccc(cc1)SCc1cc(O)nc(n1)N1CCOCC1

STK852849
Synonyms: 1-(3-methoxypropyl)-9-methyl-4-oxo-N-(1-phenylethyl)-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Smiles: COCCCn1c(cc2c1nc1c(C)cccn1c2=O)C(=O)NC(c1ccccc1)C

STK597997
Synonyms: 2-(2-hydroxyphenyl)-12-(pyridin-3-yl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
Smiles: Oc1ccc2c(c1)Oc1c(C2c2cccnc2)c2nc(nn2cn1)c1ccccc1O

STK597998
Synonyms: N-[3-(2-fluorophenyl)-4-oxo-4H-thiochromen-2-yl]-2-phenylacetamide
Smiles: O=C(Nc1sc2ccccc2c(=O)c1c1ccccc1F)Cc1ccccc1

STK597999
Synonyms: 6-benzyl-2-[(3,4-dimethoxybenzyl)amino]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
Smiles: COc1cc(CNc2nn3c(n2)nc(c(c3O)Cc2ccccc2)C)ccc1OC

STK852852
Synonyms: 6,7-dimethyl-N-[(2Z)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxo-4H-chromene-2-carboxamide
Smiles: CC(Cc1n[nH]/c(=N/C(=O)c2cc(=O)c3c(o2)cc(c(c3)C)C)/s1)C

STK598002
Synonyms: 2-[2-(3,4-dimethoxyphenyl)ethyl]-1-(3-ethoxyphenyl)-5,7-dimethyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Smiles: CCOc1cccc(c1)C1N(CCc2ccc(c(c2)OC)OC)C(=O)c2c1c(=O)c1c(o2)c(C)cc(c1)C

STK852853
Synonyms: 2-[2-amino-5-(3,4-dimethoxyphenyl)pyrimidin-4-yl]-5-[(2,5-dimethylbenzyl)oxy]phenol
Smiles: COc1cc(ccc1OC)c1cnc(nc1c1ccc(cc1O)OCc1cc(C)ccc1C)N

STK598003
Synonyms: methylN-[(4-ethoxyphenyl)carbamoyl]-D-leucinate
Smiles: CCOc1ccc(cc1)NC(=O)N[C@@H](C(=O)OC)CC(C)C

STK598007
Synonyms: (3aR,6aS)-3-(2-chlorophenyl)-5-(4-methoxybenzyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: COc1ccc(cc1)CN1C(=O)[C@@H]2[C@H](C1=O)C(=NO2)c1ccccc1Cl

STK852854
Synonyms: 5-(3-chlorophenyl)-2,4-dihydroxy-1-(2-methoxyethyl)-1,5-dihydro-6H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-6-one
Smiles: COCCn1c(O)nc(c2c1=NC1=C(C2c2cccc(c2)Cl)C(=O)c2c1cccc2)O

STK598009
Synonyms: [1-(aminomethyl)cyclohexyl]aceticacid
Smiles: NCC1(CCCCC1)CC(=O)O

STK852855
Synonyms: 3-(3,4-dimethoxyphenyl)-7-[(4-fluorobenzyl)oxy]-4H-chromen-4-one
Smiles: COc1cc(ccc1OC)c1coc2c(c1=O)ccc(c2)OCc1ccc(cc1)F

STK852857
Synonyms: 4-(3-chlorophenyl)-3-(2-hydroxyphenyl)-5-[2-(4-methoxyphenyl)ethyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1ccc(cc1)CCN1C(=O)c2c(C1c1cccc(c1)Cl)c([nH]n2)c1ccccc1O

STK852858
Synonyms: 3-(furan-2-yl)-7-(2-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: Cc1ccccc1n1ncc2c1ncn1c2nnc1c1ccco1

STK598015
Synonyms: 5-[(2-methylbenzyl)oxy]-2-(5-phenylpyrimidin-4-yl)phenol
Smiles: Oc1cc(ccc1c1ncncc1c1ccccc1)OCc1ccccc1C

STK598016
Synonyms: 4-{[(2Z)-3-(2-fluorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)/N=C/1\SC2C(N1c1ccccc1F)CS(=O)(=O)C2

STK598021
Synonyms: 10-(3-hydroxyphenyl)-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)c1n2CCOC(c2c2c1c(=O)n(C)c(=O)n2C)c1cccc(c1)O

STK852859
Synonyms: N-(2-methoxyethyl)-N-[(6-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]pyridine-4-carboxamide
Smiles: COCCN(C(=O)c1ccncc1)Cc1cc2cc(C)ccc2[nH]c1=O

STK598027
Synonyms: 2-[(5Z)-5-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)-4-oxopentyl]-1H-isoindole-1,3(2H)-dione
Smiles: COc1cc2/C(=C/C(=O)CCCN3C(=O)c4c(C3=O)cccc4)/NCCc2cc1OC

STK598030
Synonyms: 2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]acetamide
Smiles: COc1ccc2c(c1)[nH]cc2CCNC(=O)CN1C(=O)S/C(=C\c2ccccc2)/C1=O

STK598034
Synonyms: 2-ethyl-8,9-bis(4-methoxyphenyl)furo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccc(cc1)c1oc2c(c1c1ccc(cc1)OC)c1nc(nn1cn2)CC

STK598035
Synonyms: 8-methoxy-3-(3-methoxypropyl)-2-(propan-2-yl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Smiles: COCCCn1c(nc2c(c1=O)c(=O)c1c(o2)cc(cc1)OC)C(C)C

STK598036
Synonyms: 4-[(4-benzylpiperidin-1-yl)methyl]-6,8-dimethyl-2H-chromen-2-one
Smiles: Cc1cc(C)c2c(c1)c(CN1CCC(CC1)Cc1ccccc1)cc(=O)o2

STK598037
Synonyms: 3-[(3a'S,6a'R)-5'-butyl-7-chloro-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: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CCC(=O)O)C(=O)Nc2c1cccc2Cl

STK598040
Synonyms: 8,9-bis(4-methoxyphenyl)furo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1ccc(cc1)c1oc2c(c1c1ccc(cc1)OC)c1ncnn1cn2

STK598041
Synonyms: 5-[(2-fluorobenzyl)oxy]-2-[5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]phenol
Smiles: COc1ccccc1c1c(ncnc1C(F)(F)F)c1ccc(cc1O)OCc1ccccc1F

STK598048
Synonyms: 3-[(2Z)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)acetyl]-N,N-dimethylbenzenesulfonamide
Smiles: COc1cc2CCN/C(=C\C(=O)c3cccc(c3)S(=O)(=O)N(C)C)/c2cc1OC

STK598049
Synonyms: N-{1-[2-(2-methoxyphenyl)ethyl]-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl}acetamide
Smiles: COc1ccccc1CCN1C2=C(C(C1=O)(NC(=O)C)C(F)(F)F)C(=O)CC(C2)(C)C

STK598051
Synonyms: 5-(2-hydroxy-4-methylphenyl)-N-[4-(piperidin-1-ylsulfonyl)phenyl]-1H-pyrazole-3-carboxamide
Smiles: Cc1ccc(c(c1)O)c1[nH]nc(c1)C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCCC1

STK598052
Synonyms: methyl(3-{(E)-[2-hydroxy-1-(4-methylbenzyl)-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)Cc1ccc(cc1)C)O

STK598053
Synonyms: 7-hydroxy-4-(4-methoxyphenyl)-8-{[(pyridin-4-ylmethyl)amino]methyl}-2H-chromen-2-one
Smiles: COc1ccc(cc1)c1cc(=O)oc2c1ccc(c2CNCc1ccncc1)O

STK598054
Synonyms: 6-hydroxy-3-methyl-5-[2-(pyridin-2-yl)ethyl]-2-sulfanylpyrimidin-4(3H)-one
Smiles: Oc1nc(S)n(c(=O)c1CCc1ccccn1)C

STK598056
Synonyms: (5E)-5-{[5-(4-acetylphenyl)furan-2-yl]methylidene}-1-(1,1-dioxidotetrahydrothiophen-3-yl)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(C)/C(=C\c2ccc(o2)c2ccc(cc2)C(=O)C)/C(=O)N(C1=O)C1CCS(=O)(=O)C1

STK852866
Synonyms: 8-(3,4-dimethoxyphenyl)-3-(4-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: N#CC1=C2SCN(CN2C(=O)CC1c1ccc(c(c1)OC)OC)c1ccc(cc1)C

STK598061
Synonyms: 5-(3-cyclopropyl-1H-pyrazol-5-yl)-4-(3,5-dichlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1cc(Cl)cc(c1)n1c(=S)[nH]nc1c1[nH]nc(c1)C1CC1

STK598066
Synonyms: 8-[(4-ethylpiperazin-1-yl)methyl]-7-hexyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCn1c(CN2CCN(CC2)CC)nc2c1c(=O)n(c(=O)n2C)C

STK598070
Synonyms: 2-(morpholin-4-ium-4-yl)-5-[(naphthalen-1-ylmethyl)amino]benzoate
Smiles: [O-]C(=O)c1cc(NCc2cccc3c2cccc3)ccc1[NH+]1CCOCC1

STK598072
Synonyms: tert-butyl4-({(2S)-1-[(4-fluorobenzyl)amino]-1-oxo-3-phenylpropan-2-yl}carbamoyl)piperidine-1-carboxylate
Smiles: O=C([C@H](Cc1ccccc1)NC(=O)C1CCN(CC1)C(=O)OC(C)(C)C)NCc1ccc(cc1)F

STK598073
Synonyms: [1-(4-hydroxy-2-sulfanyl-1H-imidazol-5-yl)-4,4,6,8-tetramethyl-2-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl]propanedinitrile
Smiles: N#CC(C1(c2[nH]c(nc2O)S)C(=O)N2c3c1cc(C)cc3C(=CC2(C)C)C)C#N

STK598074
Synonyms: 6-chloro-7-methyl-N-[3-(methylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-oxo-4H-chromene-2-carboxamide
Smiles: CNC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)cc(c(c3)Cl)C)sc2c1CCCC2

STK852868
Synonyms: 2-(1H-benzimidazol-2-yl)-5-(4-methylphenyl)-1,2-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(cc1)c1[nH]n(c(=O)c1)c1nc2c([nH]1)cccc2

STK852869
Synonyms: 6,8-dimethyl-N-[4-(morpholin-4-ylsulfonyl)phenyl]-4-oxo-4H-chromene-2-carboxamide
Smiles: Cc1cc(C)c2c(c1)c(=O)cc(o2)C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCOCC1

STK598085
Synonyms: (5Z)-3-(4-methoxybenzyl)-5-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1)CN1C(=S)S/C(=C\c2ccc3c(c2)CC(O3)C)/C1=O

STK852871
Synonyms: 6,7-dimethyl-4-oxo-N-(pyridin-4-ylmethyl)-4H-chromene-2-carboxamide
Smiles: O=C(c1cc(=O)c2c(o1)cc(c(c2)C)C)NCc1ccncc1

STK598088
Synonyms: 4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxy-3,5-dimethylphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1ccc(cc1OC)CCN1C(=O)c2c(C1c1cccc(c1)Cl)c([nH]n2)c1cc(C)cc(c1O)C

STK598089
Synonyms: N,N-diethyl-3-[(2-phenyl[1]benzofuro[3,2-d]pyrimidin-4-yl)oxy]propan-1-amine
Smiles: CCN(CCCOc1nc(nc2c1oc1c2cccc1)c1ccccc1)CC

STK598090
Synonyms: (2E)-3-(2-chlorophenyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-methoxybenzyl)prop-2-enamide
Smiles: COc1ccc(cc1)CN(C1CCS(=O)(=O)C1)C(=O)/C=C/c1ccccc1Cl

STK598099
Synonyms: N-(2-cyanoethyl)-N-methylmorpholine-4-carboxamide
Smiles: CN(C(=O)N1CCOCC1)CCC#N

STK598101
Synonyms: 2-(4-ethylphenyl)-4-[(4-methylphenyl)carbonyl]hexahydropyrrolo[3,4-a]pyrrolizine-1,3(2H,4H)-dione
Smiles: CCc1ccc(cc1)N1C(=O)C2C(C1=O)C1N(C2C(=O)c2ccc(cc2)C)CCC1

STK598102
Synonyms: 3-(1H-benzimidazol-2-yl)-N-(furan-3-ylmethyl)propanamide
Smiles: O=C(CCc1nc2c([nH]1)cccc2)NCc1cocc1

STK598104
Synonyms: 5-fluoro-N-(4-fluorophenyl)-1H-indole-2-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1[nH]c2c(c1)cc(cc2)F

STK598110
Synonyms: (5Z)-5-({3-[2-methyl-4-(propan-2-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-3-pentyl-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2C)OC(C)C)c2ccccc2)/C1=O

STK852874
Synonyms: (2Z)-2-(2,5-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl4-chlorobutanoate
Smiles: ClCCCC(=O)Oc1ccc2c(c1)O/C(=C\c1cc(OC)ccc1OC)/C2=O

STK852876
Synonyms: N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]-N-phenylmethanesulfonamide
Smiles: O=c1[nH]c2ccccc2cc1CN(S(=O)(=O)C)c1ccccc1

STK598123
Synonyms: (5Z)-1-benzyl-5-[5-(3-hydroxy-4-methoxyphenyl)pyrazolidin-3-ylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1O)C1NN/C(=C\2/C(=O)NC(=O)N(C2=O)Cc2ccccc2)/C1

STK598130
Synonyms: propyl4-[(5-{2-hydroxy-4-[(2-methylbenzyl)oxy]phenyl}-3-methyl-1H-pyrazol-4-yl)oxy]benzoate
Smiles: CCCOC(=O)c1ccc(cc1)Oc1c(C)n[nH]c1c1ccc(cc1O)OCc1ccccc1C

STK598134
Synonyms: 2-{4-[(4-chlorobenzyl)oxy]phenyl}-5-{[3-(morpholin-4-yl)propyl]amino}-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1NCCCN1CCOCC1)c1ccc(cc1)OCc1ccc(cc1)Cl

STK598137
Synonyms: (1Z,2E)-1-{2-(4-ethylphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}-3-phenylprop-2-en-1-olate
Smiles: CCc1ccc(cc1)C1/C(=C(\C=C\c2ccccc2)/[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1

STK598140
Synonyms:
Smiles: CCC([C@@H](C(=O)NC1CCCC1)NC(=O)[C@H]1NCc2c(C1)cccc2)C