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

Systemtic Name: 4-methylsulfanyl-2-[(phenylmethylsulfanyl)carbonylamino]butanoic acid Openeye Name: 2-(benzylsulfanylcarbonylamino)-4-methylsulfanyl-butanoic acid CAS Name: 4-(methylthio)-2-[[oxo-(phenylmethylthio)methyl]amino]butanoic acid IUPAC Name: 2-(benzylsulfanylcarbonylamino)-4-methylsulfanylbutanoic acid Traditional Name: 2-[(benzylthio)carbonylamino]-4-(methylthio)butyric acid Formula: C13H17NO3S2 MolecularWeight: 299.40898

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)SCC1=CC=CC=C1

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)SCC1=CC=CC=C1

InChI

InChI=1S/C13H17NO3S2/c1-18-8-7-11(12(15)16)14-13(17)19-9-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,14,17)(H,15,16)