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Substance Name: 2-Propen-1-one, 1-(1H-benzimidazol-2-yl)-3-(4-chlorophenyl)-
RN: 36998-77-3
InChIKey: VLOYJJMQBUMMMP-JXMROGBWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H11-Cl-N2-O

Molecular Weight

  • 282.729
 
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Names and Synonyms

Synonym

  • 1-(1H-Benzimidazol-2-yl)-3-(4-chlorophenyl)-2-propen-1-one

Systematic Name

  • 2-Propen-1-one, 1-(1H-benzimidazol-2-yl)-3-(4-chlorophenyl)-

Registry Numbers

CAS Registry Number

  • 36998-77-3

System Generated Number

  • 0036998773

Structure Descriptors

InChI

1S/C16H11ClN2O/c17-12-8-5-11(6-9-12)7-10-15(20)16-18-13-3-1-2-4-14(13)19-16/h1-10H,(H,18,19)/b10-7+

InChIKey

VLOYJJMQBUMMMP-JXMROGBWSA-N

Smiles

C(\C=C\c1ccc(cc1)Cl)(=O)c1nc2c([nH]1)cccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 2gm/kg (2000mg/kg)   United States Patent Document. Vol. #3755314,