5-[(2-acetamido-3-methyl-butanoyl)amino]thiophene-2-carboxylic acid

Systemtic Name: 5-[(2-acetamido-3-methyl-butanoyl)amino]thiophene-2-carboxylic acid Openeye Name: 5-[(2-acetamido-3-methyl-butanoyl)amino]thiophene-2-carboxylic acid CAS Name: 5-[(2-acetamido-3-methyl-1-oxobutyl)amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[(2-acetamido-3-methylbutanoyl)amino]thiophene-2-carboxylic acid Traditional Name: 5-[(2-acetamido-3-methyl-butanoyl)amino]-2-thenoic acid Formula: C12H16N2O4S MolecularWeight: 284.33144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O4S/c1-6(2)10(13-7(3)15)11(16)14-9-5-4-8(19-9)12(17)18/h4-6,10H,1-3H3,(H,13,15)(H,14,16)(H,17,18)