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

Systemtic Name: 2-(3-methylbutanoylamino)-3-sulfanyl-propanoic acid Openeye Name: 2-(3-methylbutanoylamino)-3-sulfanyl-propanoic acid CAS Name: 3-mercapto-2-[(3-methyl-1-oxobutyl)amino]propanoic acid IUPAC Name: 2-(3-methylbutanoylamino)-3-sulfanylpropanoic acid Traditional Name: 2-(isovalerylamino)-3-mercapto-propionic acid Formula: C8H15NO3S MolecularWeight: 205.2746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H15NO3S/c1-5(2)3-7(10)9-6(4-13)8(11)12/h5-6,13H,3-4H2,1-2H3,(H,9,10)(H,11,12)