ethyl 3-methyl-4-(methylcarbamoyl)-5-(3-phenylpropanoylamino)thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-4-(methylcarbamoyl)-5-(3-phenylpropanoylamino)thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-4-(methylcarbamoyl)-5-(3-phenylpropanoylamino)thiophene-2-carboxylate CAS Name: 3-methyl-4-(methylcarbamoyl)-5-[(1-oxo-3-phenylpropyl)amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-4-(methylcarbamoyl)-5-(3-phenylpropanoylamino)thiophene-2-carboxylate Traditional Name: 5-(hydrocinnamoylamino)-3-methyl-4-(methylcarbamoyl)thiophene-2-carboxylic acid ethyl ester Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCC2=CC=CC=C2)C(=O)NC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCC2=CC=CC=C2)C(=O)NC)C

InChI

InChI=1S/C19H22N2O4S/c1-4-25-19(24)16-12(2)15(17(23)20-3)18(26-16)21-14(22)11-10-13-8-6-5-7-9-13/h5-9H,4,10-11H2,1-3H3,(H,20,23)(H,21,22)