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Substance Name: 1H-Pyrazole-3-carboxamide, 5-methyl-N-((4-methylphenyl)methyl)-4-nitro-
RN: 80030-78-0
InChIKey: SJYLXSDQUIDCAC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H14-N4-O3

Molecular Weight

  • 274.2786
 
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Names and Synonyms

Synonym

  • 5-Methyl-N-((4-methylphenyl)methyl)-4-nitro-1H-pyrazole-3-carboxamide

Systematic Name

  • 1H-Pyrazole-3-carboxamide, 5-methyl-N-((4-methylphenyl)methyl)-4-nitro-

Registry Numbers

CAS Registry Number

  • 80030-78-0

System Generated Number

  • 0080030780

Structure Descriptors

InChI

1S/C13H14N4O3/c1-8-3-5-10(6-4-8)7-14-13(18)11-12(17(19)20)9(2)15-16-11/h3-6H,7H2,1-2H3,(H,14,18)(H,15,16)

InChIKey

SJYLXSDQUIDCAC-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)CNC(=O)c2c(c([nH]n2)C)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Farmaco, Edizione Scientifica. Vol. 38, Pg. 369, 1983.