2-[(2-methyl-3-sulfanyl-propanoyl)-(phenylmethyl)amino]ethanoic acid

Systemtic Name: 2-[(2-methyl-3-sulfanyl-propanoyl)-(phenylmethyl)amino]ethanoic acid Openeye Name: 2-[benzyl-(2-methyl-3-sulfanyl-propanoyl)amino]acetic acid CAS Name: 2-[(3-mercapto-2-methyl-1-oxopropyl)-(phenylmethyl)amino]acetic acid IUPAC Name: 2-[benzyl-(2-methyl-3-sulfanylpropanoyl)amino]acetic acid Traditional Name: 2-[benzyl-(3-mercapto-2-methyl-propanoyl)amino]acetic acid Formula: C13H17NO3S MolecularWeight: 267.34398

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)N(CC1=CC=CC=C1)CC(=O)O

Isomeric SMILES

CC(CS)C(=O)N(CC1=CC=CC=C1)CC(=O)O

InChI

InChI=1S/C13H17NO3S/c1-10(9-18)13(17)14(8-12(15)16)7-11-5-3-2-4-6-11/h2-6,10,18H,7-9H2,1H3,(H,15,16)