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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=C(C=CS1)C(=O)O)NC(=O)C

Isomeric SMILES

CC(C)C(C(=O)NC1=C(C=CS1)C(=O)O)NC(=O)C

InChI

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