4-methylsulfanyl-2-[(phenylmethyl)-(3-sulfanylpropanoyl)amino]butanoic acid

Systemtic Name: 4-methylsulfanyl-2-[(phenylmethyl)-(3-sulfanylpropanoyl)amino]butanoic acid Openeye Name: 2-[benzyl(3-sulfanylpropanoyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[(3-mercapto-1-oxopropyl)-(phenylmethyl)amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[benzyl(3-sulfanylpropanoyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[benzyl(3-mercaptopropanoyl)amino]-4-(methylthio)butyric acid Formula: C15H21NO3S2 MolecularWeight: 327.46214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO3S2/c1-21-10-8-13(15(18)19)16(14(17)7-9-20)11-12-5-3-2-4-6-12/h2-6,13,20H,7-11H2,1H3,(H,18,19)