4-methylsulfanyl-2-[2-(phenylmethylsulfanyl)ethanoylamino]butanoic acid

Systemtic Name: 4-methylsulfanyl-2-[2-(phenylmethylsulfanyl)ethanoylamino]butanoic acid Openeye Name: 2-[(2-benzylsulfanylacetyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 4-(methylthio)-2-[[1-oxo-2-(phenylmethylthio)ethyl]amino]butanoic acid IUPAC Name: 2-[(2-benzylsulfanylacetyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[2-(benzylthio)acetyl]amino]-4-(methylthio)butyric acid Formula: C14H19NO3S2 MolecularWeight: 313.43556

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)CSCC1=CC=CC=C1

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)CSCC1=CC=CC=C1

InChI

InChI=1S/C14H19NO3S2/c1-19-8-7-12(14(17)18)15-13(16)10-20-9-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3,(H,15,16)(H,17,18)