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Substance Name: 1H-1,4-Benzodiazepine-3-carbonitrile, 2,3-dihydro-7-chloro-2-oxo-5-phenyl-
RN: 61984-07-4
InChIKey: GKYBVPVCYREJLV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H10-Cl-N3-O

Molecular Weight

  • 295.728
 
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Names and Synonyms

Synonyms

  • 2,3-Dihydro-7-chloro-2-oxo-5-phenyl-1H-1,4-benzodiazepine-3-carbonitrile
  • 5-25-08-00123 (Beilstein Handbook Reference)
  • 7-Chloro-3-cyano-1,3-dihydro-5-phenyl-2H-1,4-benzodiazepin-2-one
  • BRN 0680092

Systematic Name

  • 1H-1,4-Benzodiazepine-3-carbonitrile, 2,3-dihydro-7-chloro-2-oxo-5-phenyl-

Registry Numbers

CAS Registry Number

  • 61984-07-4

System Generated Number

  • 0061984074

Structure Descriptors

InChI

1S/C16H10ClN3O/c17-11-6-7-13-12(8-11)15(10-4-2-1-3-5-10)19-14(9-18)16(21)20-13/h1-8,14H,(H,20,21)

InChIKey

GKYBVPVCYREJLV-UHFFFAOYSA-N

Smiles

c1ccc(cc1)C2=NC(C(=O)Nc3c2cc(cc3)Cl)C#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 776, 1977.