4-methylsulfinyl-2-[[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]butanoic acid

Systemtic Name: 4-methylsulfinyl-2-[[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]butanoic acid Openeye Name: 2-[(2-benzyl-3-sulfanyl-propanoyl)amino]-4-methylsulfinyl-butanoic acid CAS Name: 2-[[2-(mercaptomethyl)-1-oxo-3-phenylpropyl]amino]-4-methylsulfinylbutanoic acid IUPAC Name: 2-[(2-benzyl-3-sulfanylpropanoyl)amino]-4-methylsulfinylbutanoic acid Traditional Name: 2-[(2-benzyl-3-mercapto-propanoyl)amino]-4-methylsulfinyl-butyric acid Formula: C15H21NO4S2 MolecularWeight: 343.46154

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CCC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)CS

Isomeric SMILES

CS(=O)CCC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)CS

InChI

InChI=1S/C15H21NO4S2/c1-22(20)8-7-13(15(18)19)16-14(17)12(10-21)9-11-5-3-2-4-6-11/h2-6,12-13,21H,7-10H2,1H3,(H,16,17)(H,18,19)