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Substance Name: Thieno(2,3-d)isothiazole, 3-(4-chloro-1H-pyrazol-1-yl)-5-phenyl-, 1,1-dioxide
RN: 113387-72-7
InChIKey: CZHZCMXKLNQMGU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H8-Cl-N3-O2-S2

Molecular Weight

  • 349.8212
 
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Names and Synonyms

Synonyms

  • 3-(4-Chloro-1H-pyrazol-1-yl)-5-phenylthieno(2,3-d)isothiazole 1,1-dioxide
  • BRN 5991420

Systematic Name

  • Thieno(2,3-d)isothiazole, 3-(4-chloro-1H-pyrazol-1-yl)-5-phenyl-, 1,1-dioxide

Registry Numbers

CAS Registry Number

  • 113387-72-7

System Generated Number

  • 0113387727

Structure Descriptors

InChI

1S/C14H8ClN3O2S2/c15-10-7-16-18(8-10)14-13-12(22(19,20)17-14)6-11(21-13)9-4-2-1-3-5-9/h1-8H

InChIKey

CZHZCMXKLNQMGU-UHFFFAOYSA-N

Smiles

c1ccc(cc1)c2cc3c(s2)C(=NS3(=O)=O)n4cc(cn4)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.