ethyl 4,5-dimethyl-2-[2-(4-methyl-2-oxidanylidene-quinolin-1-yl)butanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[2-(4-methyl-2-oxidanylidene-quinolin-1-yl)butanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[2-(4-methyl-2-oxo-1-quinolyl)butanoylamino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[2-(4-methyl-2-oxo-1-quinolinyl)-1-oxobutyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[2-(4-methyl-2-oxoquinolin-1-yl)butanoylamino]thiophene-3-carboxylate Traditional Name: 2-[2-(2-keto-4-methyl-1-quinolyl)butanoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=C(S1)C)C)C(=O)OCC)N2C3=CC=CC=C3C(=CC2=O)C

Isomeric SMILES

CCC(C(=O)NC1=C(C(=C(S1)C)C)C(=O)OCC)N2C3=CC=CC=C3C(=CC2=O)C

InChI

InChI=1S/C23H26N2O4S/c1-6-17(25-18-11-9-8-10-16(18)13(3)12-19(25)26)21(27)24-22-20(23(28)29-7-2)14(4)15(5)30-22/h8-12,17H,6-7H2,1-5H3,(H,24,27)