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Substance Name: 4-((5-Chloro-2-fluoro-6-methyl-4-pyrimidinyl)amino)-5-hydroxy-6-((2-sulphophenyl)azo)naphthalene-1,7-disulphonic acid, potassium sodium salt
RN: 83400-16-2
InChIKey: PYTNJUDHTUOJHP-JZYARHMISA-N

Molecular Formula

  • C21-H15-Cl-F-N5-O10-S3.x-K.x-Na

Molecular Weight

  • 710.1115
 
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Names and Synonyms

Synonym

  • EINECS 280-432-6

Systematic Names

  • 1,7-Naphthalenedisulfonic acid, 4-((5-chloro-2-fluoro-6-methyl-4-pyrimidinyl)amino)-5-hydroxy-6-((2-sulfophenyl)azo)-, potassium sodium salt
  • 4-((5-Chloro-2-fluoro-6-methyl-4-pyrimidinyl)amino)-5-hydroxy-6-((2-sulphophenyl)azo)naphthalene-1,7-disulphonic acid, potassium sodium salt

Registry Numbers

CAS Registry Number

  • 83400-16-2

System Generated Number

  • 0083400162

Molecular Formulas

Molecular Formula

  • C21-H15-Cl-F-N5-O10-S3.x-K.x-Na

Molecular Formula Fragments

  • C21-H15-Cl-F-N5-O10-S3
  • COMPONENT
  • K
  • Na

Structure Descriptors

InChI

1S/C21H15ClFN5O10S3.K.Na/c1-9-17(22)20(26-21(23)24-9)25-12-6-7-13(39(30,31)32)10-8-15(41(36,37)38)18(19(29)16(10)12)28-27-11-4-2-3-5-14(11)40(33,34)35;;/h2-8,29H,1H3,(H,24,25,26)(H,30,31,32)(H,33,34,35)(H,36,37,38);;/q;2*+1/b28-27+;;

InChIKey

PYTNJUDHTUOJHP-JZYARHMISA-N

Smiles

Cc1c(c(nc(n1)F)Nc2ccc(c3c2c(c(c(c3)S(=O)(=O)O)/N=N/c4ccccc4S(=O)(=O)O)O)S(=O)(=O)O)Cl.[Na+].[K+]