S-[8-[2-[6-(1,2-dithiolan-3-yl)-2-oxidanylidene-hexyl]pyrrolidin-1-yl]-3-ethanoylsulfanyl-8-oxidanylidene-octyl] ethanethioate

Systemtic Name: S-[8-[2-[6-(1,2-dithiolan-3-yl)-2-oxidanylidene-hexyl]pyrrolidin-1-yl]-3-ethanoylsulfanyl-8-oxidanylidene-octyl] ethanethioate Openeye Name: S-[3-acetylsulfanyl-8-[2-[6-(dithiolan-3-yl)-2-oxo-hexyl]pyrrolidin-1-yl]-8-oxo-octyl] ethanethioate CAS Name: ethanethioic acid S-[3-(acetylthio)-8-[2-[6-(3-dithiolanyl)-2-oxohexyl]-1-pyrrolidinyl]-8-oxooctyl] ester IUPAC Name: S-[3-acetylsulfanyl-8-[2-[6-(dithiolan-3-yl)-2-oxohexyl]pyrrolidin-1-yl]-8-oxooctyl] ethanethioate Traditional Name: ethanethioic acid S-[3-(acetylthio)-8-[2-[6-(dithiolan-3-yl)-2-keto-hexyl]pyrrolidino]-8-keto-octyl] ester Formula: C25H41NO4S4 MolecularWeight: 547.85734

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCC(CCCCC(=O)N1CCCC1CC(=O)CCCCC2CCSS2)SC(=O)C

Isomeric SMILES

CC(=O)SCCC(CCCCC(=O)N1CCCC1CC(=O)CCCCC2CCSS2)SC(=O)C

InChI

InChI=1S/C25H41NO4S4/c1-19(27)31-16-13-23(33-20(2)28)10-5-6-12-25(30)26-15-7-8-21(26)18-22(29)9-3-4-11-24-14-17-32-34-24/h21,23-24H,3-18H2,1-2H3