Methyl 4-cyano-4-[[(dodecylthio)thioxomethyl]thio]pentanoate

CAS Registry Number®

870532-87-9
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CAS Name

Methyl 4-cyano-4-[[(dodecylthio)thioxomethyl]thio]pentanoate

Molecular Formula

C20H35NO2S3

Molecular Mass

417.69

Cite this Page

Methyl 4-cyano-4-[[(dodecylthio)thioxomethyl]thio]pentanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=870532-87-9 (retrieved 2024-08-12) (CAS RN: 870532-87-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H35NO2S3/c1-4-5-6-7-8-9-10-11-12-13-16-25-19(24)26-20(2,17-21)15-14-18(22)23-3/h4-16H2,1-3H3

InChIKey

InChIKey=SDIPWHBLCNZSEW-UHFFFAOYSA-N

SMILES

C(SC(SCCCCCCCCCCCC)=S)(CCC(OC)=O)(C#N)C

Canonical SMILES

N#CC(SC(=S)SCCCCCCCCCCCC)(C)CCC(=O)OC

Other Names for this Substance

  • Pentanoic acid, 4-cyano-4-[[(dodecylthio)thioxomethyl]thio]-, methyl ester
  • Methyl 4-cyano-4-[[(dodecylthio)thioxomethyl]thio]pentanoate
  • Methyl 4-Cyano-4-[(dodecylsulfanylthiocarbonyl)sulfanyl]pentanoate
  • BM 1448
  • Methyl 4-cyano-4-(dodecylthiocarbonothioylthio)pentanoate