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

Systemtic Name: ethyl 3-methyl-5-(3-methylbutanoylamino)thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-(3-methylbutanoylamino)thiophene-2-carboxylate CAS Name: 3-methyl-5-[(3-methyl-1-oxobutyl)amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-(3-methylbutanoylamino)thiophene-2-carboxylate Traditional Name: 5-(isovalerylamino)-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C13H19NO3S MolecularWeight: 269.35986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)CC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)CC(C)C)C

InChI

InChI=1S/C13H19NO3S/c1-5-17-13(16)12-9(4)7-11(18-12)14-10(15)6-8(2)3/h7-8H,5-6H2,1-4H3,(H,14,15)