S1,S5-bis(hydroxymethyl) 3-ethyl-3-[2-(hydroxymethylsulfanyl)-2-oxidanylidene-ethyl]pentanebis(thioate)

Systemtic Name: S1,S5-bis(hydroxymethyl) 3-ethyl-3-[2-(hydroxymethylsulfanyl)-2-oxidanylidene-ethyl]pentanebis(thioate) Openeye Name: S1,S5-bis(hydroxymethyl) 3-ethyl-3-[2-(hydroxymethylsulfanyl)-2-oxo-ethyl]pentanebis(thioate) CAS Name: 3-ethyl-3-[2-(hydroxymethylthio)-2-oxoethyl]pentanebis(thioic acid) S1,S5-bis(hydroxymethyl) ester IUPAC Name: 1-S,5-S-bis(hydroxymethyl) 3-ethyl-3-[2-(hydroxymethylsulfanyl)-2-oxoethyl]pentanebis(thioate) Traditional Name: 3-ethyl-3-[2-keto-2-(methylolthio)ethyl]pentanebis(thioic acid) S1,S5-dimethylol ester Formula: C12H20O6S3 MolecularWeight: 356.4786

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)SCO)(CC(=O)SCO)CC(=O)SCO

Isomeric SMILES

CCC(CC(=O)SCO)(CC(=O)SCO)CC(=O)SCO

InChI

InChI=1S/C12H20O6S3/c1-2-12(3-9(16)19-6-13,4-10(17)20-7-14)5-11(18)21-8-15/h13-15H,2-8H2,1H3