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

Systemtic Name: 4-methylsulfanyl-2-[2-(phenylmethylsulfanyl)ethylamino]butanoic acid Openeye Name: 2-(2-benzylsulfanylethylamino)-4-methylsulfanyl-butanoic acid CAS Name: 4-(methylthio)-2-[2-(phenylmethylthio)ethylamino]butanoic acid IUPAC Name: 2-(2-benzylsulfanylethylamino)-4-methylsulfanylbutanoic acid Traditional Name: 2-[2-(benzylthio)ethylamino]-4-(methylthio)butyric acid Formula: C14H21NO2S2 MolecularWeight: 299.45204

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NCCSCC1=CC=CC=C1

Isomeric SMILES

CSCCC(C(=O)O)NCCSCC1=CC=CC=C1

InChI

InChI=1S/C14H21NO2S2/c1-18-9-7-13(14(16)17)15-8-10-19-11-12-5-3-2-4-6-12/h2-6,13,15H,7-11H2,1H3,(H,16,17)