ethyl 2-[3-(4,8-dimethyl-2-oxidanylidene-quinolin-1-yl)propanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(4,8-dimethyl-2-oxidanylidene-quinolin-1-yl)propanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4,8-dimethyl-2-oxo-1-quinolyl)propanoylamino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[3-(4,8-dimethyl-2-oxo-1-quinolinyl)-1-oxopropyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4,8-dimethyl-2-oxoquinolin-1-yl)propanoylamino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[3-(2-keto-4,8-dimethyl-1-quinolyl)propanoylamino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C27H26N2O4S MolecularWeight: 474.57134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CCN3C(=O)C=C(C4=C3C(=CC=C4)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CCN3C(=O)C=C(C4=C3C(=CC=C4)C)C

InChI

InChI=1S/C27H26N2O4S/c1-4-33-27(32)24-21(19-10-6-5-7-11-19)16-34-26(24)28-22(30)13-14-29-23(31)15-18(3)20-12-8-9-17(2)25(20)29/h5-12,15-16H,4,13-14H2,1-3H3,(H,28,30)