Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Semapimod mesylate
RN: 872830-80-3
UNII: 8W415THB21
InChIKey: CKWNYVLFZNKVGX-RTQZJKMDSA-N

Molecular Formula

  • C34-H52-N18-O2.4C-H4-O3-S

Molecular Weight

  • 1129.3312
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Semapimod mesylate

Synonyms

  • Decanediamide, N1,N10-bis(3,5-bis(1-(2-(aminoiminomethyl)hydrazinylidene)ethyl)phenyl)-, methanesulfonate
  • Semapimod mesylate
  • Semapimod tetramesylate
  • UNII-8W415THB21

Registry Numbers

CAS Registry Number

  • 872830-80-3

FDA UNII

  • 8W415THB21

System Generated Number

  • 0872830803

Structure Descriptors

InChI

1S/C34H52N18O2.4CH4O3S/c1-19(45-49-31(35)36)23-13-24(20(2)46-50-32(37)38)16-27(15-23)43-29(53)11-9-7-5-6-8-10-12-30(54)44-28-17-25(21(3)47-51-33(39)40)14-26(18-28)22(4)48-52-34(41)42;4*1-5(2,3)4/h13-18H,5-12H2,1-4H3,(H,43,53)(H,44,54)(H4,35,36,49)(H4,37,38,50)(H4,39,40,51)(H4,41,42,52);4*1H3,(H,2,3,4)/b45-19+,46-20+,47-21+,48-22+;;;;

InChIKey

CKWNYVLFZNKVGX-RTQZJKMDSA-N

Smiles

C/C(=N\NC(=N)N)/c1cc(cc(c1)/C(=N/NC(=N)N)/C)NC(=O)CCCCCCCCC(=O)Nc2cc(cc(c2)/C(=N/NC(=N)N)/C)/C(=N/NC(=N)N)/C.CS(=O)(=O)O.CS(=O)(=O)O.CS(=O)(=O)O.CS(=O)(=O)O