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Substance Name: 1H-Benzotriazole, 1-thieno(2,3-d)isothiazol-3-yl-, S(sup 1),S(sup 1)-dioxide
RN: 119120-83-1
InChIKey: POVKYZPVQIIMDN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H6-N4-O2-S2

Molecular Weight

  • 290.3264
 
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Names and Synonyms

Synonyms

  • 1-Thieno(2,3-d)isothiazol-3-yl-1H-benzotriazole S(sup 1),S(sup 1)-dioxide
  • BRN 5978718

Systematic Names

  • 1H-Benzotriazole, 1-thieno(2,3-d)isothiazol-3-yl-, S',S'-dioxide
  • 1H-Benzotriazole, 1-thieno(2,3-d)isothiazol-3-yl-, S(sup 1),S(sup 1)-dioxide

Registry Numbers

CAS Registry Number

  • 119120-83-1

System Generated Number

  • 0119120831

Structure Descriptors

InChI

1S/C11H6N4O2S2/c16-19(17)9-5-6-18-10(9)11(13-19)15-8-4-2-1-3-7(8)12-14-15/h1-6H

InChIKey

POVKYZPVQIIMDN-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)nnn2C3=NS(=O)(=O)c4c3scc4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 500mg/kg (500mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 23, Pg. 329, 1988.