methyl 5-(phenylmethyl)-2-[[2-(4-propan-2-ylphenyl)quinolin-4-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-(phenylmethyl)-2-[[2-(4-propan-2-ylphenyl)quinolin-4-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-benzyl-2-[[2-(4-isopropylphenyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 2-[[oxo-[2-(4-propan-2-ylphenyl)-4-quinolinyl]methyl]amino]-5-(phenylmethyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-benzyl-2-[[2-(4-propan-2-ylphenyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 5-benzyl-2-[(2-p-cumenylquinoline-4-carbonyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C32H28N2O3S MolecularWeight: 520.64132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=C(S4)CC5=CC=CC=C5)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=C(S4)CC5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C32H28N2O3S/c1-20(2)22-13-15-23(16-14-22)29-19-26(25-11-7-8-12-28(25)33-29)30(35)34-31-27(32(36)37-3)18-24(38-31)17-21-9-5-4-6-10-21/h4-16,18-20H,17H2,1-3H3,(H,34,35)