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Substance Name: Sodium alpha-methyl 5-((6-methoxy-3-(4-sulphonato-2-butyl)benzoxazol-2(3H)-ylidene)ethylidene)-3-methyl-4-oxo-2-thioxoimidazolidin-1-ylacetate
RN: 84434-25-3
InChIKey: RWKNHTJJTCJTKM-BBAFFWIBSA-M

Molecular Formula

  • C21-H25-N3-O8-S2.Na

Molecular Weight

  • 533.5556
 
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Names and Synonyms

Synonym

  • EINECS 282-825-8

Systematic Name

  • Sodium alpha-methyl 5-((6-methoxy-3-(4-sulphonato-2-butyl)benzoxazol-2(3H)-ylidene)ethylidene)-3-methyl-4-oxo-2-thioxoimidazolidin-1-ylacetate

Registry Numbers

CAS Registry Number

  • 84434-25-3

System Generated Number

  • 0084434253

Molecular Formulas

Molecular Formula

  • C21-H25-N3-O8-S2.Na

Molecular Formula Fragments

  • C21-H25-N3-O8-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C21H25N3O8S2.Na/c1-12(9-10-34(28,29)30)23-15-6-5-14(31-4)11-17(15)32-18(23)8-7-16-19(25)22(3)21(33)24(16)13(2)20(26)27;/h5-8,11-13H,9-10H2,1-4H3,(H,26,27)(H,28,29,30);/q;+1/p-1/b16-7+,18-8+;

InChIKey

RWKNHTJJTCJTKM-BBAFFWIBSA-M

Smiles

CC(CCS(=O)(=O)[O-])N\1c2ccc(cc2O/C1=C/C=C/3\C(=O)N(C(=S)N3C(C)C(=O)O)C)OC.[Na+]