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

Systemtic Name: methyl 2-[[2-(4-methylphenyl)quinolin-4-yl]carbonylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 4-phenyl-2-[[2-(p-tolyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 2-[[[2-(4-methylphenyl)-4-quinolinyl]-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(4-methylphenyl)quinoline-4-carbonyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 4-phenyl-2-[[2-(p-tolyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C29H22N2O3S MolecularWeight: 478.56158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C29H22N2O3S/c1-18-12-14-20(15-13-18)25-16-22(21-10-6-7-11-24(21)30-25)27(32)31-28-26(29(33)34-2)23(17-35-28)19-8-4-3-5-9-19/h3-17H,1-2H3,(H,31,32)