propan-2-yl 2-(3,3-diphenylpropanoylamino)-4-ethyl-5-methyl-thiophene-3-carboxylate

Systemtic Name: propan-2-yl 2-(3,3-diphenylpropanoylamino)-4-ethyl-5-methyl-thiophene-3-carboxylate Openeye Name: isopropyl 2-(3,3-diphenylpropanoylamino)-4-ethyl-5-methyl-thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[(1-oxo-3,3-diphenylpropyl)amino]-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-(3,3-diphenylpropanoylamino)-4-ethyl-5-methylthiophene-3-carboxylate Traditional Name: 2-(3,3-diphenylpropanoylamino)-4-ethyl-5-methyl-thiophene-3-carboxylic acid isopropyl ester Formula: C26H29NO3S MolecularWeight: 435.57836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC(C)C)NC(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC(C)C)NC(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C26H29NO3S/c1-5-21-18(4)31-25(24(21)26(29)30-17(2)3)27-23(28)16-22(19-12-8-6-9-13-19)20-14-10-7-11-15-20/h6-15,17,22H,5,16H2,1-4H3,(H,27,28)