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

Systemtic Name: methyl 4,5-dimethyl-2-[[2-[4-(2-methylpropyl)phenyl]quinolin-4-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(4-isobutylphenyl)quinoline-4-carbonyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[[2-[4-(2-methylpropyl)phenyl]-4-quinolinyl]-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[[2-[4-(2-methylpropyl)phenyl]quinoline-4-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(4-isobutylphenyl)quinoline-4-carbonyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C28H28N2O3S MolecularWeight: 472.59852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)CC(C)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)CC(C)C)C

InChI

InChI=1S/C28H28N2O3S/c1-16(2)14-19-10-12-20(13-11-19)24-15-22(21-8-6-7-9-23(21)29-24)26(31)30-27-25(28(32)33-5)17(3)18(4)34-27/h6-13,15-16H,14H2,1-5H3,(H,30,31)