Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Hydrogen-2-(2-methyl-3-(3-(3-sulphonatopropyl)-3H-benzothiazol-2-ylidene)prop-1-enyl)-3-(3-sulphonatopropyl)benzothiazolium, sodium salt
RN: 59867-77-5
InChIKey: ROLJYEITTGZWQG-UHFFFAOYSA-M

Molecular Formula

  • C24-H26-N2-O6-S4.Na

Molecular Weight

  • 588.7235
 
* 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

Synonym

  • EINECS 261-967-4

Systematic Name

  • Hydrogen-2-(2-methyl-3-(3-(3-sulphonatopropyl)-3H-benzothiazol-2-ylidene)prop-1-enyl)-3-(3-sulphonatopropyl)benzothiazolium, sodium salt

Registry Numbers

CAS Registry Number

  • 59867-77-5

System Generated Number

  • 0059867775

Molecular Formulas

Molecular Formula

  • C24-H26-N2-O6-S4.Na

Molecular Formula Fragments

  • C24-H26-N2-O6-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C24H26N2O6S4.Na/c1-18(16-23-25(12-6-14-35(27,28)29)19-8-2-4-10-21(19)33-23)17-24-26(13-7-15-36(30,31)32)20-9-3-5-11-22(20)34-24;/h2-5,8-11,16-17H,6-7,12-15H2,1H3,(H-,27,28,29,30,31,32);/q;+1/p-1

InChIKey

ROLJYEITTGZWQG-UHFFFAOYSA-M

Smiles

C/C(=C\c1[n+](c2ccccc2s1)CCCS(=O)(=O)[O-])/C=C/3\N(c4ccccc4S3)CCCS(=O)(=O)[O-].[Na+]