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Substance Name: Sodium 2,5-dichloro-4-(4-((5-((ethylphenylamino)sulphonyl)-o-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonate
RN: 85455-43-2
InChIKey: BCPRZMBBZVMNDU-IRWWKPKRSA-M

Molecular Formula

  • C25-H23-Cl2-N5-O6-S2.Na

Molecular Weight

  • 646.5058
 
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Names and Synonyms

Synonym

  • EINECS 287-278-9

Systematic Name

  • Sodium 2,5-dichloro-4-(4-((5-((ethylphenylamino)sulphonyl)-o-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonate

Registry Numbers

CAS Registry Number

  • 85455-43-2

System Generated Number

  • 0085455432

Molecular Formulas

Molecular Formula

  • C25-H23-Cl2-N5-O6-S2.Na

Molecular Formula Fragments

  • C25-H23-Cl2-N5-O6-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C25H23Cl2N5O6S2.Na/c1-4-31(17-8-6-5-7-9-17)39(34,35)18-11-10-15(2)21(12-18)28-29-24-16(3)30-32(25(24)33)22-13-20(27)23(14-19(22)26)40(36,37)38;/h5-14,24H,4H2,1-3H3,(H,36,37,38);/q;+1/p-1/b29-28+;

InChIKey

BCPRZMBBZVMNDU-IRWWKPKRSA-M

Smiles

CCN(c1ccccc1)S(=O)(=O)c2ccc(c(c2)/N=N/C3C(=NN(C3=O)c4cc(c(cc4Cl)S(=O)(=O)[O-])Cl)C)C.[Na+]