methyl 4-(4-ethoxyphenyl)-2-[[2-(3-propoxyphenyl)quinolin-4-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-ethoxyphenyl)-2-[[2-(3-propoxyphenyl)quinolin-4-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(4-ethoxyphenyl)-2-[[2-(3-propoxyphenyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-ethoxyphenyl)-2-[[oxo-[2-(3-propoxyphenyl)-4-quinolinyl]methyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-ethoxyphenyl)-2-[[2-(3-propoxyphenyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 4-p-phenetyl-2-[[2-(3-propoxyphenyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C33H30N2O5S MolecularWeight: 566.6667

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=CS4)C5=CC=C(C=C5)OCC)C(=O)OC

Isomeric SMILES

CCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=CS4)C5=CC=C(C=C5)OCC)C(=O)OC

InChI

InChI=1S/C33H30N2O5S/c1-4-17-40-24-10-8-9-22(18-24)29-19-26(25-11-6-7-12-28(25)34-29)31(36)35-32-30(33(37)38-3)27(20-41-32)21-13-15-23(16-14-21)39-5-2/h6-16,18-20H,4-5,17H2,1-3H3,(H,35,36)