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Substance Name: 1H-Pyrazolecarboxamide, 4-bromo-5-methyl-N-(3-(trifluoromethyl)phenyl)-
RN: 101708-04-7
InChIKey: SAVMNLAMXVSNRW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H9-Br-F3-N3-O

Molecular Weight

  • 348.1211
 
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Names and Synonyms

Synonym

  • 4-Bromo-3-methyl-N-(m-trifluoromethyl)phenyl-1H-pyrazol-5-ylcarboxamide

Systematic Name

  • 1H-Pyrazolecarboxamide, 4-bromo-5-methyl-N-(3-(trifluoromethyl)phenyl)-

Registry Numbers

CAS Registry Number

  • 101708-04-7

System Generated Number

  • 0101708047

Structure Descriptors

InChI

1S/C12H9BrF3N3O/c1-6-9(13)10(19-18-6)11(20)17-8-4-2-3-7(5-8)12(14,15)16/h2-5H,1H3,(H,17,20)(H,18,19)

InChIKey

SAVMNLAMXVSNRW-UHFFFAOYSA-N

Smiles

Cc1c(c(n[nH]1)C(=O)Nc2cccc(c2)C(F)(F)F)Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral > 2gm/kg (2000mg/kg)   Journal of Pharmaceutical Sciences. Vol. 74, Pg. 1013, 1985.