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Substance Name: 1H-Benzimidazole-2-acetonitrile, alpha-((2-chlorophenyl)methylene)-
RN: 63052-08-4
InChIKey: BPSIMQTUJJIVOO-FMIVXFBMSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H10-Cl-N3

Molecular Weight

  • 279.729
 
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Names and Synonyms

Synonyms

  • 5-25-05-00247 (Beilstein Handbook Reference)
  • alpha-((2-Chlorophenyl)methylene)-1H-benzimidazole-2-acetonitrile
  • BRN 0889702

Systematic Name

  • 1H-Benzimidazole-2-acetonitrile, alpha-((2-chlorophenyl)methylene)-

Registry Numbers

CAS Registry Number

  • 63052-08-4

System Generated Number

  • 0063052084

Structure Descriptors

InChI

1S/C16H10ClN3/c17-13-6-2-1-5-11(13)9-12(10-18)16-19-14-7-3-4-8-15(14)20-16/h1-9H,(H,19,20)/b12-9+

InChIKey

BPSIMQTUJJIVOO-FMIVXFBMSA-N

Smiles

c1(\C(=C\c2c(Cl)cccc2)C#N)nc2ccccc2[nH]1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 3gm/kg (3000mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 33, 217.