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Substance Name: Imidodicarbonimidic diamide, N-(4-((4-((chloromethyl)sulfonyl)-2-nitrophenyl)amino)phenyl)-, monohydrochloride
RN: 56948-04-0
InChIKey: JUYHDBZJBOOQDH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H16-Cl-N7-O4-S.Cl-H

Molecular Weight

  • 462.3163
 
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Names and Synonyms

Synonym

  • N-(4-((4-((Chloromethyl)sulfonyl)-2-nitrophenyl)amino)phenyl)imidodicarbonimidic diamide HCl

Systematic Name

  • Imidodicarbonimidic diamide, N-(4-((4-((chloromethyl)sulfonyl)-2-nitrophenyl)amino)phenyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 56948-04-0

System Generated Number

  • 0056948040

Molecular Formulas

Molecular Formula

  • C15-H16-Cl-N7-O4-S.Cl-H

Molecular Formula Fragments

  • C15-H16-Cl-N7-O4-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H16ClN7O4S.ClH/c16-8-28(26,27)11-5-6-12(13(7-11)23(24)25)21-9-1-3-10(4-2-9)22(14(17)18)15(19)20;/h1-7,21H,8H2,(H3,17,18)(H3,19,20);1H

InChIKey

JUYHDBZJBOOQDH-UHFFFAOYSA-N

Smiles

c1cc(ccc1Nc2ccc(cc2[N+](=O)[O-])S(=O)(=O)CCl)N(C(=N)N)C(=N)N.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 3gm/kg (3000mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 27, Pg. 283, 1975.