2-(2-methylpropanoylamino)-3-sulfanyl-propanoic acid

Systemtic Name: 2-(2-methylpropanoylamino)-3-sulfanyl-propanoic acid Openeye Name: 2-(2-methylpropanoylamino)-3-sulfanyl-propanoic acid CAS Name: 3-mercapto-2-[(2-methyl-1-oxopropyl)amino]propanoic acid IUPAC Name: 2-(2-methylpropanoylamino)-3-sulfanylpropanoic acid Traditional Name: 2-(isobutyrylamino)-3-mercapto-propionic acid Formula: C7H13NO3S MolecularWeight: 191.24802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(CS)C(=O)O

Isomeric SMILES

CC(C)C(=O)NC(CS)C(=O)O

InChI

InChI=1S/C7H13NO3S/c1-4(2)6(9)8-5(3-12)7(10)11/h4-5,12H,3H2,1-2H3,(H,8,9)(H,10,11)