Product OPENEYE NAME: N-[4-(4-ethoxyphenyl)thiazol-2-yl]-2-methyl-quinoline-7-carboxamide
CAS Name: N-[4-(4-ethoxyphenyl)-2-thiazolyl]-2-methyl-7-quinolinecarboxamide
IUPAC NAME: N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-2-methylquinoline-7-carboxamide
SYSTEMATIC NAME: N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-2-methyl-quinoline-7-carboxamide
MOLECULAR FORMULA: C22H19N3O2S
MOLECULAR WEIGHT: 389.47016
SMILES: CCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC4=C(C=CC(=N4)C)C=C3
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Product OPENEYE NAME: ethyl 2-[[2-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-ethyl]-1-oxo-5-isoquinolyl]oxy]acetate
CAS Name: 2-[[2-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]-1-oxo-5-isoquinolinyl]oxy]acetic acid ethyl ester
IUPAC NAME: ethyl 2-[2-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxyacetate
SYSTEMATIC NAME: ethyl 2-[2-[2-[[2-chloranyl-5-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]-1-oxidanylidene-isoquinolin-5-yl]oxyethanoate
MOLECULAR FORMULA: C22H18ClF3N2O5
MOLECULAR WEIGHT: 482.83693
SMILES: CCOC(=O)COC1=CC=CC2=C1C=CN(C2=O)CC(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl
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Product OPENEYE NAME: 6-[[4-(4-methoxyphenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione
CAS Name: 6-[[4-(4-methoxyphenyl)-5-(propylthio)-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione
IUPAC NAME: 6-[[4-(4-methoxyphenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione
SYSTEMATIC NAME: 6-[[4-(4-methoxyphenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione
MOLECULAR FORMULA: C17H19N5O3S
MOLECULAR WEIGHT: 373.42946
SMILES: CCCSC1=NN=C(N1C2=CC=C(C=C2)OC)CC3=CC(=O)NC(=O)N3
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Product OPENEYE NAME: 1-[(3-chlorophenyl)methyl]-3-(2-methoxy-4-methyl-phenyl)-1-(3-pyridylmethyl)thiourea
CAS Name: 1-[(3-chlorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(3-pyridinylmethyl)thiourea
IUPAC NAME: 1-[(3-chlorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea
SYSTEMATIC NAME: 1-[(3-chlorophenyl)methyl]-3-(2-methoxy-4-methyl-phenyl)-1-(pyridin-3-ylmethyl)thiourea
MOLECULAR FORMULA: C22H22ClN3OS
MOLECULAR WEIGHT: 411.94758
SMILES: CC1=CC(=C(C=C1)NC(=S)N(CC2=CC(=CC=C2)Cl)CC3=CN=CC=C3)OC
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Product OPENEYE NAME: N-[2-(2,3-dimethylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-methyl-3-nitro-benzamide
CAS Name: N-[2-(2,3-dimethylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-methyl-3-nitrobenzamide
IUPAC NAME: N-[2-(2,3-dimethylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-methyl-3-nitrobenzamide
SYSTEMATIC NAME: N-[2-(2,3-dimethylphenyl)-5,5-bis(oxidanylidene)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-methyl-3-nitro-benzamide
MOLECULAR FORMULA: C21H20N4O5S
MOLECULAR WEIGHT: 440.4723
SMILES: CC1=C(C(=CC=C1)N2C(=C3CS(=O)(=O)CC3=N2)NC(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-])C
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Product OPENEYE NAME: 1-(azepan-1-yl)-2-[1-(m-tolylmethyl)indol-3-yl]sulfanyl-ethanone
CAS Name: 1-(1-azepanyl)-2-[[1-[(3-methylphenyl)methyl]-3-indolyl]thio]ethanone
IUPAC NAME: 1-(azepan-1-yl)-2-[1-[(3-methylphenyl)methyl]indol-3-yl]sulfanylethanone
SYSTEMATIC NAME: 1-(azepan-1-yl)-2-[1-[(3-methylphenyl)methyl]indol-3-yl]sulfanyl-ethanone
MOLECULAR FORMULA: C24H28N2OS
MOLECULAR WEIGHT: 392.55692
SMILES: CC1=CC(=CC=C1)CN2C=C(C3=CC=CC=C32)SCC(=O)N4CCCCCC4
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Product OPENEYE NAME: methyl 2-[7-(4-fluorophenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanylpropanoate
CAS Name: 2-[[7-(4-fluorophenyl)-5-phenyl-4-pyrrolo[2,3-d]pyrimidinyl]thio]propanoic acid methyl ester
IUPAC NAME: methyl 2-[7-(4-fluorophenyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-yl]sulfanylpropanoate
SYSTEMATIC NAME: methyl 2-[7-(4-fluorophenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanylpropanoate
MOLECULAR FORMULA: C22H18FN3O2S
MOLECULAR WEIGHT: 407.460623
SMILES: CC(C(=O)OC)SC1=NC=NC2=C1C(=CN2C3=CC=C(C=C3)F)C4=CC=CC=C4
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Product OPENEYE NAME: N-[2-[3-[2-(2,5-dimethylanilino)-2-oxo-ethyl]sulfanylindol-1-yl]ethyl]-4-methoxy-benzamide
CAS Name: N-[2-[3-[[2-(2,5-dimethylanilino)-2-oxoethyl]thio]-1-indolyl]ethyl]-4-methoxybenzamide
IUPAC NAME: N-[2-[3-[2-(2,5-dimethylanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-methoxybenzamide
SYSTEMATIC NAME: N-[2-[3-[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]-4-methoxy-benzamide
MOLECULAR FORMULA: C28H29N3O3S
MOLECULAR WEIGHT: 487.61316
SMILES: CC1=CC(=C(C=C1)C)NC(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC=C(C=C4)OC
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Product OPENEYE NAME: benzyl N-[1-(cyclohexylcarbamoyl)-2-methyl-propyl]carbamate
CAS Name: N-[1-(cyclohexylamino)-3-methyl-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester
IUPAC NAME: benzyl N-[1-(cyclohexylamino)-3-methyl-1-oxobutan-2-yl]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[1-(cyclohexylamino)-3-methyl-1-oxidanylidene-butan-2-yl]carbamate
MOLECULAR FORMULA: C19H28N2O3
MOLECULAR WEIGHT: 332.43722
SMILES: CC(C)C(C(=O)NC1CCCCC1)NC(=O)OCC2=CC=CC=C2
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Product OPENEYE NAME: benzyl N-[1-[[2-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-(pyrimidin-2-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]phenyl]methyl]-2,5-dioxo-pyrrolidin-3-yl]carbamate
CAS Name: N-[1-[[2-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[(2-pyrimidinylthio)methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]-2,5-dioxo-3-pyrrolidinyl]carbamic acid (phenylmethyl) ester
IUPAC NAME: benzyl N-[1-[[2-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-(pyrimidin-2-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]phenyl]methyl]-2,5-dioxopyrrolidin-3-yl]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[1-[[2-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-(pyrimidin-2-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]phenyl]methyl]-2,5-bis(oxidanylidene)pyrrolidin-3-yl]carbamate
MOLECULAR FORMULA: C42H40N4O7S
MOLECULAR WEIGHT: 744.8546
SMILES: CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)C4=CC=CC=C4CN5C(=O)CC(C5=O)NC(=O)OCC6=CC=CC=C6)CSC7=NC=CC=N7
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Product OPENEYE NAME: 5-[[4-[4-(benzimidazol-1-ylmethyl)-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-2-yl]phenyl]methylamino]-5-oxo-pentanoic acid
CAS Name: 5-[[4-[4-(1-benzimidazolylmethyl)-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-2-yl]phenyl]methylamino]-5-oxopentanoic acid
IUPAC NAME: 5-[[4-[4-(benzimidazol-1-ylmethyl)-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-2-yl]phenyl]methylamino]-5-oxopentanoic acid
SYSTEMATIC NAME: 5-[[4-[4-(benzimidazol-1-ylmethyl)-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-2-yl]phenyl]methylamino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C32H35N3O6
MOLECULAR WEIGHT: 557.6368
SMILES: CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)CNC(=O)CCCC(=O)O)CN4C=NC5=CC=CC=C54
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Product OPENEYE NAME: N-[[3-[3-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[[methyl(1-phenylethyl)amino]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]benzamide
CAS Name: N-[[3-[3-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[[methyl(1-phenylethyl)amino]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]benzamide
IUPAC NAME: N-[[3-[3-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[[methyl(1-phenylethyl)amino]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]benzamide
SYSTEMATIC NAME: N-[[3-[3-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[[methyl(1-phenylethyl)amino]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]benzamide
MOLECULAR FORMULA: C42H44N2O4
MOLECULAR WEIGHT: 640.80976
SMILES: CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=CC(=C3)C4=CC(=CC=C4)CNC(=O)C5=CC=CC=C5)CN(C)C(C)C6=CC=CC=C6
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Product OPENEYE NAME: 2,2,2-trichloro-N-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]acetamide
CAS Name: 2,2,2-trichloro-N-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[[2-(1-pyrrolidinylmethyl)-1-pyrrolidinyl]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]acetamide
IUPAC NAME: 2,2,2-trichloro-N-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]acetamide
SYSTEMATIC NAME: 2,2,2-tris(chloranyl)-N-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]ethanamide
MOLECULAR FORMULA: C37H44Cl3N3O4
MOLECULAR WEIGHT: 701.12196
SMILES: CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)C4=CC(=CC=C4)CNC(=O)C(Cl)(Cl)Cl)CN5CCCC5CN6CCCC6
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Product OPENEYE NAME: N-[3-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-2-yl]phenyl]acetamide
CAS Name: N-[3-[4-[(1,3-benzothiazol-2-ylthio)methyl]-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-2-yl]phenyl]acetamide
IUPAC NAME: N-[3-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-2-yl]phenyl]acetamide
SYSTEMATIC NAME: N-[3-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-2-yl]phenyl]ethanamide
MOLECULAR FORMULA: C28H28N2O4S2
MOLECULAR WEIGHT: 520.66292
SMILES: CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC(=CC=C3)NC(=O)C)CSC4=NC5=CC=CC=C5S4
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Product OPENEYE NAME: 5-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[[methyl-[1-(2-naphthyl)ethyl]amino]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methylamino]-5-oxo-pentanoic acid
CAS Name: 5-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[[methyl-[1-(2-naphthalenyl)ethyl]amino]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methylamino]-5-oxopentanoic acid
IUPAC NAME: 5-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[[methyl(1-naphthalen-2-ylethyl)amino]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methylamino]-5-oxopentanoic acid
SYSTEMATIC NAME: 5-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[[methyl(1-naphthalen-2-ylethyl)amino]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methylamino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C44H48N2O6
MOLECULAR WEIGHT: 700.86172
SMILES: CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)C4=CC(=CC=C4)CNC(=O)CCCC(=O)O)CN(C)C(C)C5=CC6=CC=CC=C6C=C5
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Product OPENEYE NAME: s-indacene-1,3,5,7-tetrone
CAS Name: s-indacene-1,3,5,7-tetrone
IUPAC NAME: s-indacene-1,3,5,7-tetrone
SYSTEMATIC NAME: s-indacene-1,3,5,7-tetrone
MOLECULAR FORMULA: C12H6O4
MOLECULAR WEIGHT: 214.17364
SMILES: C1C(=O)C2=CC3=C(C=C2C1=O)C(=O)CC3=O
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C36H44O4
MOLECULAR WEIGHT: 540.73216
SMILES: CCC1(C2=CC=C(O2)C3(CCCCC3)C4=CC=C(O4)C(C5=CC=C(O5)C6(CCCCC6)C7=CC=C1O7)(C)CC)C
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Product OPENEYE NAME: [4-[[(2-methylbenzoyl)hydrazono]methyl]phenyl] 2-fluorobenzoate
CAS Name: 2-fluorobenzoic acid [4-[[[(2-methylphenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester
IUPAC NAME: [4-[[(2-methylbenzoyl)hydrazinylidene]methyl]phenyl] 2-fluorobenzoate
SYSTEMATIC NAME: [4-[[(2-methylphenyl)carbonylhydrazinylidene]methyl]phenyl] 2-fluoranylbenzoate
MOLECULAR FORMULA: C22H17FN2O3
MOLECULAR WEIGHT: 376.380383
SMILES: CC1=CC=CC=C1C(=O)NN=CC2=CC=C(C=C2)OC(=O)C3=CC=CC=C3F
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