(2S)-2-[[(2R)-2-phenyl-2-phenylsulfanyl-ethanoyl]amino]pentanedioic acid

Systemtic Name: (2S)-2-[[(2R)-2-phenyl-2-phenylsulfanyl-ethanoyl]amino]pentanedioic acid Openeye Name: (2S)-2-[[(2R)-2-phenyl-2-phenylsulfanyl-acetyl]amino]pentanedioic acid CAS Name: (2S)-2-[[(2R)-1-oxo-2-phenyl-2-(phenylthio)ethyl]amino]pentanedioic acid IUPAC Name: (2S)-2-[[(2R)-2-phenyl-2-phenylsulfanylacetyl]amino]pentanedioic acid Traditional Name: (2S)-2-[[(2R)-2-phenyl-2-(phenylthio)acetyl]amino]glutaric acid Formula: C19H19NO5S MolecularWeight: 373.42286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC(CCC(=O)O)C(=O)O)SC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)SC2=CC=CC=C2

InChI

InChI=1S/C19H19NO5S/c21-16(22)12-11-15(19(24)25)20-18(23)17(13-7-3-1-4-8-13)26-14-9-5-2-6-10-14/h1-10,15,17H,11-12H2,(H,20,23)(H,21,22)(H,24,25)/t15-,17+/m0/s1