methyl 2-acetamido-5-butyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-acetamido-5-butyl-thiophene-3-carboxylate Openeye Name: methyl 2-acetamido-5-butyl-thiophene-3-carboxylate CAS Name: 2-acetamido-5-butyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-acetamido-5-butylthiophene-3-carboxylate Traditional Name: 2-acetamido-5-butyl-thiophene-3-carboxylic acid methyl ester Formula: C12H17NO3S MolecularWeight: 255.33328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(S1)NC(=O)C)C(=O)OC

Isomeric SMILES

CCCCC1=CC(=C(S1)NC(=O)C)C(=O)OC

InChI

InChI=1S/C12H17NO3S/c1-4-5-6-9-7-10(12(15)16-3)11(17-9)13-8(2)14/h7H,4-6H2,1-3H3,(H,13,14)