3-ethyl-3-(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)-2,4-bis(sulfanylmethyl)pentanedioic acid

Systemtic Name: 3-ethyl-3-(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)-2,4-bis(sulfanylmethyl)pentanedioic acid Openeye Name: 3-ethyl-3-[2-hydroxy-2-oxo-1-(sulfanylmethyl)ethyl]-2,4-bis(sulfanylmethyl)pentanedioic acid CAS Name: 3-ethyl-3-(1-hydroxy-3-mercapto-1-oxopropan-2-yl)-2,4-bis(mercaptomethyl)pentanedioic acid IUPAC Name: 3-ethyl-3-(1-hydroxy-1-oxo-3-sulfanylpropan-2-yl)-2,4-bis(sulfanylmethyl)pentanedioic acid Traditional Name: 3-ethyl-3-[2-hydroxy-2-keto-1-(mercaptomethyl)ethyl]-2,4-bis(mercaptomethyl)glutaric acid Formula: C12H20O6S3 MolecularWeight: 356.4786

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CS)C(=O)O)(C(CS)C(=O)O)C(CS)C(=O)O

Isomeric SMILES

CCC(C(CS)C(=O)O)(C(CS)C(=O)O)C(CS)C(=O)O

InChI

InChI=1S/C12H20O6S3/c1-2-12(6(3-19)9(13)14,7(4-20)10(15)16)8(5-21)11(17)18/h6-8,19-21H,2-5H2,1H3,(H,13,14)(H,15,16)(H,17,18)