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Substance Name: 1,1'-((4-(((2,6-Dimethoxypyrimidin-4-yl)amino)sulphonyl)phenyl)imino)bis(ethanesulphonic) acid, trisodium salt
RN: 85926-98-3
InChIKey: UBGSUWXUCXWQDQ-UHFFFAOYSA-N

Molecular Formula

  • C16-H22-N4-O10-S3.3Na

Molecular Weight

  • 595.5358
 
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Names and Synonyms

Synonym

  • EINECS 288-869-4

Systematic Name

  • 1,1'-((4-(((2,6-Dimethoxypyrimidin-4-yl)amino)sulphonyl)phenyl)imino)bis(ethanesulphonic) acid, trisodium salt

Registry Numbers

CAS Registry Number

  • 85926-98-3

System Generated Number

  • 0085926983

Molecular Formulas

Molecular Formula

  • C16-H22-N4-O10-S3.3Na

Molecular Formula Fragments

  • C16-H22-N4-O10-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C16H22N4O10S3.3Na/c1-10(32(23,24)25)20(11(2)33(26,27)28)12-5-7-13(8-6-12)31(21,22)19-14-9-15(29-3)18-16(17-14)30-4;;;/h5-11H,1-4H3,(H,17,18,19)(H,23,24,25)(H,26,27,28);;;/q;3*+1

InChIKey

UBGSUWXUCXWQDQ-UHFFFAOYSA-N

Smiles

[Na+].[Na+].[Na+].COc1cc(NS(=O)(=O)c2ccc(cc2)N(C(C)S(=O)(=O)O)C(C)S(=O)(=O)O)nc(OC)n1