ethyl 4-aminocarbonyl-3-methyl-5-(2-phenylbutanoylamino)thiophene-2-carboxylate

Systemtic Name: ethyl 4-aminocarbonyl-3-methyl-5-(2-phenylbutanoylamino)thiophene-2-carboxylate Openeye Name: ethyl 4-carbamoyl-3-methyl-5-(2-phenylbutanoylamino)thiophene-2-carboxylate CAS Name: 4-carbamoyl-3-methyl-5-[(1-oxo-2-phenylbutyl)amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-carbamoyl-3-methyl-5-(2-phenylbutanoylamino)thiophene-2-carboxylate Traditional Name: 4-carbamoyl-3-methyl-5-(2-phenylbutanoylamino)thiophene-2-carboxylic acid ethyl ester Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=C(C(=C(S2)C(=O)OCC)C)C(=O)N

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=C(C(=C(S2)C(=O)OCC)C)C(=O)N

InChI

InChI=1S/C19H22N2O4S/c1-4-13(12-9-7-6-8-10-12)17(23)21-18-14(16(20)22)11(3)15(26-18)19(24)25-5-2/h6-10,13H,4-5H2,1-3H3,(H2,20,22)(H,21,23)