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Substance Name: 3(2H)-Benzothiazoleethanesulfonamide, 2-imino-6-(trifluoromethoxy)-, monohydrochloride
RN: 130997-40-9
InChIKey: CFHRMVGCXFOFOD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H10-F3-N3-O3-S2.Cl-H

Molecular Weight

  • 377.7939
 
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Names and Synonyms

Synonyms

  • 2-(2-Imino-6-trifluoromethoxy-3-benzothiazolinyl)ethanesulphonamide hydrochloride
  • 2-Imino-6-(trifluoromethoxy)-3(2H)-benzothiazoleethanesulfonamide monohydrochloride

Systematic Name

  • 3(2H)-Benzothiazoleethanesulfonamide, 2-imino-6-(trifluoromethoxy)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 130997-40-9

System Generated Number

  • 0130997409

Molecular Formulas

Molecular Formula

  • C10-H10-F3-N3-O3-S2.Cl-H

Molecular Formula Fragments

  • C10-H10-F3-N3-O3-S2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C10H10F3N3O3S2.ClH/c11-10(12,13)19-6-1-2-7-8(5-6)20-9(14)16(7)3-4-21(15,17)18;/h1-2,5,14H,3-4H2,(H2,15,17,18);1H

InChIKey

CFHRMVGCXFOFOD-UHFFFAOYSA-N

Smiles

c1cc2c(cc1OC(F)(F)F)sc(=N)n2CCS(=O)(=O)N.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 15mg/kg (15mg/kg)   United States Patent Document. Vol. #4980356,