ethyl 2-[[2-(3,4-dimethylphenyl)quinolin-4-yl]carbonylamino]-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[2-(3,4-dimethylphenyl)quinolin-4-yl]carbonylamino]-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(3,4-dimethylphenyl)quinoline-4-carbonyl]amino]-4-(4-isobutylphenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[[2-(3,4-dimethylphenyl)-4-quinolinyl]-oxomethyl]amino]-5-methyl-4-[4-(2-methylpropyl)phenyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3,4-dimethylphenyl)quinoline-4-carbonyl]amino]-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophene-3-carboxylate Traditional Name: 2-[[2-(3,4-dimethylphenyl)quinoline-4-carbonyl]amino]-4-(4-isobutylphenyl)-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C36H36N2O3S MolecularWeight: 576.74764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)CC(C)C)C)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=C(C=C5)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)CC(C)C)C)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=C(C=C5)C)C

InChI

InChI=1S/C36H36N2O3S/c1-7-41-36(40)33-32(26-16-13-25(14-17-26)18-21(2)3)24(6)42-35(33)38-34(39)29-20-31(27-15-12-22(4)23(5)19-27)37-30-11-9-8-10-28(29)30/h8-17,19-21H,7,18H2,1-6H3,(H,38,39)