3-methyl-5-(2-methylpentanoylamino)thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-5-(2-methylpentanoylamino)thiophene-2-carboxylic acid Openeye Name: 3-methyl-5-(2-methylpentanoylamino)thiophene-2-carboxylic acid CAS Name: 3-methyl-5-[(2-methyl-1-oxopentyl)amino]-2-thiophenecarboxylic acid IUPAC Name: 3-methyl-5-(2-methylpentanoylamino)thiophene-2-carboxylic acid Traditional Name: 3-methyl-5-(2-methylpentanoylamino)-2-thenoic acid Formula: C12H17NO3S MolecularWeight: 255.33328

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(=O)NC1=CC(=C(S1)C(=O)O)C

Isomeric SMILES

CCCC(C)C(=O)NC1=CC(=C(S1)C(=O)O)C

InChI

InChI=1S/C12H17NO3S/c1-4-5-7(2)11(14)13-9-6-8(3)10(17-9)12(15)16/h6-7H,4-5H2,1-3H3,(H,13,14)(H,15,16)