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

Systemtic Name: ethyl 5-ethanoyl-4-methyl-2-(3-methylbutanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-4-methyl-2-(3-methylbutanoylamino)thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-[(3-methyl-1-oxobutyl)amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-methyl-2-(3-methylbutanoylamino)thiophene-3-carboxylate Traditional Name: 5-acetyl-2-(isovalerylamino)-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CC(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CC(C)C

InChI

InChI=1S/C15H21NO4S/c1-6-20-15(19)12-9(4)13(10(5)17)21-14(12)16-11(18)7-8(2)3/h8H,6-7H2,1-5H3,(H,16,18)