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Substance Name: Pyrazolo(1,5-a)pyrimidine-6-carboxylic acid, 4,7-dihydro-5-methyl-7-(2-(trifluoromethyl)phenyl)-, ethyl ester
RN: 100588-96-3
InChIKey: LYMUZKKXWMHBNS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H16-F3-N3-O2

Molecular Weight

  • 351.3264
 
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Names and Synonyms

Synonym

  • 6-Ethoxycarbonyl-5-methyl-7-(2-trifluoromethylphenyl)-4,7-dihydropyrazolo(1,5-a)pyrimidine

Systematic Name

  • Pyrazolo(1,5-a)pyrimidine-6-carboxylic acid, 4,7-dihydro-5-methyl-7-(2-(trifluoromethyl)phenyl)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 100588-96-3

System Generated Number

  • 0100588963

Structure Descriptors

InChI

1S/C17H16F3N3O2/c1-3-25-16(24)14-10(2)22-13-8-9-21-23(13)15(14)11-6-4-5-7-12(11)17(18,19)20/h4-9,15,22H,3H2,1-2H3

InChIKey

LYMUZKKXWMHBNS-UHFFFAOYSA-N

Smiles

CCOC(=O)C1=C(Nc2ccnn2C1c3ccccc3C(F)(F)F)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 250mg/kg (250mg/kg)   United States Patent Document. Vol. #4918074,
mouse LD oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4918074,