2-[(2-phenyl-2-sulfanyl-ethyl)sulfanylmethyl]pentanedioic acid

Systemtic Name: 2-[(2-phenyl-2-sulfanyl-ethyl)sulfanylmethyl]pentanedioic acid Openeye Name: 2-[(2-phenyl-2-sulfanyl-ethyl)sulfanylmethyl]pentanedioic acid CAS Name: 2-[[(2-mercapto-2-phenylethyl)thio]methyl]pentanedioic acid IUPAC Name: 2-[(2-phenyl-2-sulfanylethyl)sulfanylmethyl]pentanedioic acid Traditional Name: 2-[[(2-mercapto-2-phenyl-ethyl)thio]methyl]glutaric acid Formula: C14H18O4S2 MolecularWeight: 314.42032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CSCC(CCC(=O)O)C(=O)O)S

Isomeric SMILES

C1=CC=C(C=C1)C(CSCC(CCC(=O)O)C(=O)O)S

InChI

InChI=1S/C14H18O4S2/c15-13(16)7-6-11(14(17)18)8-20-9-12(19)10-4-2-1-3-5-10/h1-5,11-12,19H,6-9H2,(H,15,16)(H,17,18)