4-methyl-2-[(phenylmethyl)-(3-sulfanylpropanoyl)amino]pentanoic acid

Systemtic Name: 4-methyl-2-[(phenylmethyl)-(3-sulfanylpropanoyl)amino]pentanoic acid Openeye Name: 2-[benzyl(3-sulfanylpropanoyl)amino]-4-methyl-pentanoic acid CAS Name: 2-[(3-mercapto-1-oxopropyl)-(phenylmethyl)amino]-4-methylpentanoic acid IUPAC Name: 2-[benzyl(3-sulfanylpropanoyl)amino]-4-methylpentanoic acid Traditional Name: 2-[benzyl(3-mercaptopropanoyl)amino]-4-methyl-valeric acid Formula: C16H23NO3S MolecularWeight: 309.42372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO3S/c1-12(2)10-14(16(19)20)17(15(18)8-9-21)11-13-6-4-3-5-7-13/h3-7,12,14,21H,8-11H2,1-2H3,(H,19,20)