(2S)-4-methylsulfanyl-2-[3-(phenylmethylsulfanyl)propylamino]butanoic acid

Systemtic Name: (2S)-4-methylsulfanyl-2-[3-(phenylmethylsulfanyl)propylamino]butanoic acid Openeye Name: (2S)-2-(3-benzylsulfanylpropylamino)-4-methylsulfanyl-butanoic acid CAS Name: (2S)-4-(methylthio)-2-[3-(phenylmethylthio)propylamino]butanoic acid IUPAC Name: (2S)-2-(3-benzylsulfanylpropylamino)-4-methylsulfanylbutanoic acid Traditional Name: (2S)-2-[3-(benzylthio)propylamino]-4-(methylthio)butyric acid Formula: C15H23NO2S2 MolecularWeight: 313.47862

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NCCCSCC1=CC=CC=C1

Isomeric SMILES

CSCC[C@@H](C(=O)O)NCCCSCC1=CC=CC=C1

InChI

InChI=1S/C15H23NO2S2/c1-19-11-8-14(15(17)18)16-9-5-10-20-12-13-6-3-2-4-7-13/h2-4,6-7,14,16H,5,8-12H2,1H3,(H,17,18)/t14-/m0/s1