(2R)-2-[[(2S)-2-methyl-3-sulfanyl-propanoyl]amino]-3-(phenylmethylsulfanyl)propanoic acid

Systemtic Name: (2R)-2-[[(2S)-2-methyl-3-sulfanyl-propanoyl]amino]-3-(phenylmethylsulfanyl)propanoic acid Openeye Name: (2R)-3-benzylsulfanyl-2-[[(2S)-2-methyl-3-sulfanyl-propanoyl]amino]propanoic acid CAS Name: (2R)-2-[[(2S)-3-mercapto-2-methyl-1-oxopropyl]amino]-3-(phenylmethylthio)propanoic acid IUPAC Name: (2R)-3-benzylsulfanyl-2-[[(2S)-2-methyl-3-sulfanylpropanoyl]amino]propanoic acid Traditional Name: (2R)-3-(benzylthio)-2-[[(2S)-3-mercapto-2-methyl-propanoyl]amino]propionic acid Formula: C14H19NO3S2 MolecularWeight: 313.43556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](CS)C(=O)N[C@@H](CSCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C14H19NO3S2/c1-10(7-19)13(16)15-12(14(17)18)9-20-8-11-5-3-2-4-6-11/h2-6,10,12,19H,7-9H2,1H3,(H,15,16)(H,17,18)/t10-,12+/m1/s1