methyl 4-(4-methylphenyl)-2-(2-phenoxyethanoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-methylphenyl)-2-(2-phenoxyethanoylamino)thiophene-3-carboxylate Openeye Name: methyl 2-[(2-phenoxyacetyl)amino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 4-(4-methylphenyl)-2-[(1-oxo-2-phenoxyethyl)amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-methylphenyl)-2-[(2-phenoxyacetyl)amino]thiophene-3-carboxylate Traditional Name: 2-[(2-phenoxyacetyl)amino]-4-(p-tolyl)thiophene-3-carboxylic acid methyl ester Formula: C21H19NO4S MolecularWeight: 381.44486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C21H19NO4S/c1-14-8-10-15(11-9-14)17-13-27-20(19(17)21(24)25-2)22-18(23)12-26-16-6-4-3-5-7-16/h3-11,13H,12H2,1-2H3,(H,22,23)