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Substance Name: Thieno(3,4-d)isothiazole, 3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-, 1,1-dioxide
RN: 113387-63-6
InChIKey: HBCFVZASNMGVRU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H8-Cl-N3-O2-S2

Molecular Weight

  • 301.7772
 
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Names and Synonyms

Synonyms

  • 3-(4-Chloro-3,5-dimethyl-1H-pyrazol-1-yl)thieno(3,4-d)isothiazole 1,1-dioxide
  • BRN 5973553

Systematic Name

  • Thieno(3,4-d)isothiazole, 3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-, 1,1-dioxide

Registry Numbers

CAS Registry Number

  • 113387-63-6

System Generated Number

  • 0113387636

Structure Descriptors

InChI

1S/C10H8ClN3O2S2/c1-5-9(11)6(2)14(12-5)10-7-3-17-4-8(7)18(15,16)13-10/h3-4H,1-2H3

InChIKey

HBCFVZASNMGVRU-UHFFFAOYSA-N

Smiles

Cc1c(c(n(n1)C2=NS(=O)(=O)c3c2csc3)C)Cl

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.