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Substance Name: Ethanone, 1-(8-phenyl-4-(trifluoromethyl)pyrazolo(5,1-c)(1,2,4)triazin-3-yl)-2,2,2-trifluoro-
RN: 72307-45-0
InChIKey: BSVNGQSLTKXLAI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H6-F6-N4-O

Molecular Weight

  • 360.2164
 
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Names and Synonyms

Synonym

  • 1-(8-Phenyl-4-(trifluoromethyl)pyrazolo(5,1-c)(1,2,4)triazin-3-yl)-2,2,2-trifluoroethanone

Systematic Name

  • Ethanone, 1-(8-phenyl-4-(trifluoromethyl)pyrazolo(5,1-c)(1,2,4)triazin-3-yl)-2,2,2-trifluoro-

Registry Numbers

CAS Registry Number

  • 72307-45-0

System Generated Number

  • 0072307450

Structure Descriptors

InChI

1S/C14H6F6N4O/c15-13(16,17)10-9(11(25)14(18,19)20)22-23-12-8(6-21-24(10)12)7-4-2-1-3-5-7/h1-6H

InChIKey

BSVNGQSLTKXLAI-UHFFFAOYSA-N

Smiles

c1ccc(cc1)c2cnn3c2nnc(c3C(F)(F)F)C(=O)C(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 17, Pg. 52, 1979.