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Substance Name: 3(2H)-Benzothiazoleethanesulfonamide, 2-imino-N-methyl-6-(trifluoromethoxy)-, monohyrochloride
RN: 130997-41-0
InChIKey: PJBQMERIXZUYFB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H12-F3-N3-O3-S2.Cl-H

Molecular Weight

  • 391.8207
 
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Names and Synonyms

Synonyms

  • 2-Imino-N-methyl-6-(trifluoromethoxy)-3(2H)-benzothiazoleethanesulfonamide monohyrochloride
  • N-Methyl-2-(2-imino-6-trifluoromethoxy-3-benzothiazolinyl)ethanesulphonamide hydrochloride

Systematic Name

  • 3(2H)-Benzothiazoleethanesulfonamide, 2-imino-N-methyl-6-(trifluoromethoxy)-, monohyrochloride

Registry Numbers

CAS Registry Number

  • 130997-41-0

System Generated Number

  • 0130997410

Molecular Formulas

Molecular Formula

  • C11-H12-F3-N3-O3-S2.Cl-H

Molecular Formula Fragments

  • C11-H12-F3-N3-O3-S2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C11H12F3N3O3S2.ClH/c1-6-4-7-9(5-8(6)20-11(12,13)14)21-10(15)17(7)2-3-22(16,18)19;/h4-5,15H,2-3H2,1H3,(H2,16,18,19);1H

InChIKey

PJBQMERIXZUYFB-UHFFFAOYSA-N

Smiles

Cc1cc2c(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,