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Substance Name: 1H-Imidazole-4-carboxylic acid, 5-(3,3-dimethyl-1-triazenyl)-, methyl ester
RN: 10197-64-5
InChIKey: JGBCOMOYIPBHIS-ZHACJKMWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H11-N5-O2

Molecular Weight

  • 197.197
 
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Names and Synonyms

Synonyms

  • 5-(3,3-Dimethyl-1-triazenyl)-1H-imidazole-4-carboxylic acid methyl ester
  • AI3-52232
  • NSC 87982

Systematic Names

  • 1H-Imidazole-4-carboxamide, 5-(3,3-dimethyl-1-triazenyl)-, methyl ester, (9CI)
  • 1H-Imidazole-4-carboxylic acid, 5-(3,3-dimethyl-1-triazenyl)-, methyl ester
  • Imidazole-4-carboxamide, 5-(3,3-dimethyl-1-triazeno)-, methyl ester (8CI)

Registry Numbers

CAS Registry Number

  • 10197-64-5

System Generated Number

  • 0010197645

Structure Descriptors

InChI

1S/C7H11N5O2/c1-12(2)11-10-6-5(7(13)14-3)8-4-9-6/h4H,1-3H3,(H,8,9)/b11-10+

InChIKey

JGBCOMOYIPBHIS-ZHACJKMWSA-N

Smiles

c1(c(C(=O)OC)[nH]cn1)\N=N\N(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 231mg/kg (231mg/kg)   National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. Vol. JAN1986,