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Substance Name: Disodium 1-phenyl-3-((4-((2-pyrimidinylamino)sulphonyl)phenyl)amino)propane-1,3-disulphonate
RN: 97171-75-0
InChIKey: CVEFAXSOHINGPV-UHFFFAOYSA-L

Molecular Formula

  • C19-H20-N4-O8-S3.2Na

Molecular Weight

  • 572.5492
 
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Names and Synonyms

Synonym

  • EINECS 306-392-2

Systematic Name

  • Disodium 1-phenyl-3-((4-((2-pyrimidinylamino)sulphonyl)phenyl)amino)propane-1,3-disulphonate

Registry Numbers

CAS Registry Number

  • 97171-75-0

System Generated Number

  • 0097171750

Molecular Formulas

Molecular Formula

  • C19-H20-N4-O8-S3.2Na

Molecular Formula Fragments

  • C19-H20-N4-O8-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C19H20N4O8S3.2Na/c24-32(25,23-19-20-11-4-12-21-19)16-9-7-15(8-10-16)22-18(34(29,30)31)13-17(33(26,27)28)14-5-2-1-3-6-14;;/h1-12,17-18,22H,13H2,(H,20,21,23)(H,26,27,28)(H,29,30,31);;/q;2*+1/p-2

InChIKey

CVEFAXSOHINGPV-UHFFFAOYSA-L

Smiles

[Na+].[Na+].C([C@@H](S(=O)(=O)[O-])c1ccccc1)[C@@H](S(=O)(=O)[O-])Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1