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

Systemtic Name: propan-2-yl 4-ethyl-5-methyl-2-(3-methylbutanoylamino)thiophene-3-carboxylate Openeye Name: isopropyl 4-ethyl-5-methyl-2-(3-methylbutanoylamino)thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[(3-methyl-1-oxobutyl)amino]-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-ethyl-5-methyl-2-(3-methylbutanoylamino)thiophene-3-carboxylate Traditional Name: 4-ethyl-2-(isovalerylamino)-5-methyl-thiophene-3-carboxylic acid isopropyl ester Formula: C16H25NO3S MolecularWeight: 311.4396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO3S/c1-7-12-11(6)21-15(17-13(18)8-9(2)3)14(12)16(19)20-10(4)5/h9-10H,7-8H2,1-6H3,(H,17,18)