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Substance Name: Benzenamine, 4-((chloromethyl)sulfonyl)-2-nitro-N-(4-((4-nitrophenyl)thio)phenyl)-
RN: 56947-96-7
InChIKey: QUQUZQKPEDHIRY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H14-Cl-N3-O6-S2

Molecular Weight

  • 479.92
 
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Names and Synonyms

Synonyms

  • 4-((Chloromethyl)sulfonyl)-2-nitro-N-(4-((4-nitrophenyl)thio)phenyl)benzenamine
  • BRN 3077353

Systematic Name

  • Benzenamine, 4-((chloromethyl)sulfonyl)-2-nitro-N-(4-((4-nitrophenyl)thio)phenyl)-

Registry Numbers

CAS Registry Number

  • 56947-96-7

System Generated Number

  • 0056947967

Structure Descriptors

InChI

1S/C19H14ClN3O6S2/c20-12-31(28,29)17-9-10-18(19(11-17)23(26)27)21-13-1-5-15(6-2-13)30-16-7-3-14(4-8-16)22(24)25/h1-11,21H,12H2

InChIKey

QUQUZQKPEDHIRY-UHFFFAOYSA-N

Smiles

c1(c(cc(S(CCl)(=O)=O)cc1)[N+](=O)[O-])Nc1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2500mg/kg (2500mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 27, Pg. 283, 1975.