(2R)-2-[[(2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-sulfanyl-propanoate

Systemtic Name: (2R)-2-[[(2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-sulfanyl-propanoate Openeye Name: (2R)-2-[[(2S)-2-(benzyloxycarbonylamino)-4-methylsulfanyl-butanoyl]amino]-3-sulfanyl-propanoate CAS Name: (2R)-3-mercapto-2-[[(2S)-4-(methylthio)-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]propanoate IUPAC Name: (2R)-2-[[(2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-sulfanylpropanoate Traditional Name: (2R)-2-[[(2S)-2-(benzyloxycarbonylamino)-4-(methylthio)butanoyl]amino]-3-mercapto-propionate Formula: C16H21N2O5S2- MolecularWeight: 385.47834

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC(CS)C(=O)[O-])NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CSCC[C@@H](C(=O)N[C@@H](CS)C(=O)[O-])NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H22N2O5S2/c1-25-8-7-12(14(19)17-13(10-24)15(20)21)18-16(22)23-9-11-5-3-2-4-6-11/h2-6,12-13,24H,7-10H2,1H3,(H,17,19)(H,18,22)(H,20,21)/p-1/t12-,13-/m0/s1