(2R)-2-methoxy-2-[[(2S)-2-(2-methylphenyl)-3-sulfanyl-propanoyl]amino]propanoic acid

Systemtic Name: (2R)-2-methoxy-2-[[(2S)-2-(2-methylphenyl)-3-sulfanyl-propanoyl]amino]propanoic acid Openeye Name: (2R)-2-methoxy-2-[[(2S)-2-(o-tolyl)-3-sulfanyl-propanoyl]amino]propanoic acid CAS Name: (2R)-2-[[(2S)-3-mercapto-2-(2-methylphenyl)-1-oxopropyl]amino]-2-methoxypropanoic acid IUPAC Name: (2R)-2-methoxy-2-[[(2S)-2-(2-methylphenyl)-3-sulfanylpropanoyl]amino]propanoic acid Traditional Name: (2R)-2-[[(2S)-3-mercapto-2-(o-tolyl)propanoyl]amino]-2-methoxy-propionic acid Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CS)C(=O)NC(C)(C(=O)O)OC

Isomeric SMILES

CC1=CC=CC=C1[C@H](CS)C(=O)N[C@@](C)(C(=O)O)OC

InChI

InChI=1S/C14H19NO4S/c1-9-6-4-5-7-10(9)11(8-20)12(16)15-14(2,19-3)13(17)18/h4-7,11,20H,8H2,1-3H3,(H,15,16)(H,17,18)/t11-,14+/m0/s1