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

Systemtic Name: propan-2-yl 4-ethyl-5-methyl-2-(2-phenylbutanoylamino)thiophene-3-carboxylate Openeye Name: isopropyl 4-ethyl-5-methyl-2-(2-phenylbutanoylamino)thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[(1-oxo-2-phenylbutyl)amino]-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-ethyl-5-methyl-2-(2-phenylbutanoylamino)thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-(2-phenylbutanoylamino)thiophene-3-carboxylic acid isopropyl ester Formula: C21H27NO3S MolecularWeight: 373.50898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO3S/c1-6-16-14(5)26-20(18(16)21(24)25-13(3)4)22-19(23)17(7-2)15-11-9-8-10-12-15/h8-13,17H,6-7H2,1-5H3,(H,22,23)