ethyl 5-ethyl-2-(2-methylpropanoylamino)-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-(2-methylpropanoylamino)-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-(2-methylpropanoylamino)-4-phenyl-thiophene-3-carboxylate CAS Name: 5-ethyl-2-[(2-methyl-1-oxopropyl)amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-(2-methylpropanoylamino)-4-phenylthiophene-3-carboxylate Traditional Name: 5-ethyl-2-(isobutyrylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H23NO3S MolecularWeight: 345.45582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(S1)NC(=O)C(C)C)C(=O)OCC)C2=CC=CC=C2

Isomeric SMILES

CCC1=C(C(=C(S1)NC(=O)C(C)C)C(=O)OCC)C2=CC=CC=C2

InChI

InChI=1S/C19H23NO3S/c1-5-14-15(13-10-8-7-9-11-13)16(19(22)23-6-2)18(24-14)20-17(21)12(3)4/h7-12H,5-6H2,1-4H3,(H,20,21)