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Substance Name: Benzamide, 4-nitro-N-1H-1,2,4-triazol-3-yl-
RN: 36918-79-3
InChIKey: ZGALGAJAQYISLR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H7-N5-O3

Molecular Weight

  • 233.186
 
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Names and Synonyms

Synonym

  • 4-Nitro-N-1H-1,2,4-triazol-3-ylbenzamide

Systematic Name

  • Benzamide, 4-nitro-N-1H-1,2,4-triazol-3-yl-

Registry Numbers

CAS Registry Number

  • 36918-79-3

System Generated Number

  • 0036918793

Structure Descriptors

InChI

1S/C9H7N5O3/c15-8(12-9-10-5-11-13-9)6-1-3-7(4-2-6)14(16)17/h1-5H,(H2,10,11,12,13,15)

InChIKey

ZGALGAJAQYISLR-UHFFFAOYSA-N

Smiles

C(c1ccc(cc1)[N+](=O)[O-])(=O)Nc1n[nH]cn1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 14, Pg. 963, 1971.