Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1,3-Benzenedisulfonic acid, 4-(2-(2-((aminocarbonyl)amino)-4-((5-chloro-2,6-difluoro-4-pyrimidinyl)amino)phenyl)diazenyl)-, sodium salt (1:2)
RN: 73019-07-5
InChIKey: NKHYBWNQSRXAQY-YOYNBWDYSA-L

Molecular Formula

  • C17-H12-Cl-F2-N7-O7-S2.2Na

Molecular Weight

  • 607.869
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Regulatory Agencies (Superlist Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 4-((2-((Aminocarbonyl)amino)-4-((2,4-difluoro-5-chloropyrimid-6-yl)amino)phenyl)azo)-1,3-benzenedisulfonic acid, disodium salt

Systematic Names

  • 1,3-Benzenedisulfonic acid, 4-((2-((aminocarbonyl)amino)-4-((5-chloro-2,6-difluoro-4-pyrimidinyl)amino)phenyl)azo)-, disodium salt
  • 1,3-Benzenedisulfonic acid, 4-(2-(2-((aminocarbonyl)amino)-4-((5-chloro-2,6-difluoro-4-pyrimidinyl)amino)phenyl)diazenyl)-, sodium salt (1:2)

Registry Numbers

CAS Registry Number

  • 73019-07-5

Other Registry Number

  • 51811-45-1

System Generated Number

  • 0073019075

Molecular Formulas

Molecular Formula

  • C17-H12-Cl-F2-N7-O7-S2.2Na

Molecular Formula Fragments

  • C17-H12-Cl-F2-N7-O7-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C17H12ClF2N7O7S2.2Na/c18-13-14(19)24-16(20)25-15(13)22-7-1-3-9(11(5-7)23-17(21)28)26-27-10-4-2-8(35(29,30)31)6-12(10)36(32,33)34;;/h1-6H,(H3,21,23,28)(H,22,24,25)(H,29,30,31)(H,32,33,34);;/q;2*+1/p-2/b27-26+;;

InChIKey

NKHYBWNQSRXAQY-YOYNBWDYSA-L

Smiles

[Na+].[Na+].c1(cc(c(cc1)\N=N\c1c(cc(cc1)Nc1nc(nc(c1Cl)F)F)NC(=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-]