methyl 2-[[2-(2-chlorophenyl)quinolin-4-yl]carbonylamino]-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[[2-(2-chlorophenyl)quinolin-4-yl]carbonylamino]-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(2-chlorophenyl)quinoline-4-carbonyl]amino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[[[2-(2-chlorophenyl)-4-quinolinyl]-oxomethyl]amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(2-chlorophenyl)quinoline-4-carbonyl]amino]-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(2-chlorophenyl)quinoline-4-carbonyl]amino]-4-(p-tolyl)thiophene-3-carboxylic acid methyl ester Formula: C29H21ClN2O3S MolecularWeight: 513.00664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5Cl

InChI

InChI=1S/C29H21ClN2O3S/c1-17-11-13-18(14-12-17)22-16-36-28(26(22)29(34)35-2)32-27(33)21-15-25(20-8-3-5-9-23(20)30)31-24-10-6-4-7-19(21)24/h3-16H,1-2H3,(H,32,33)