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Substance Name: 4H-(1,2,4)Triazolo(4,3-a)(1,4)benzodiazepine, 8-chloro-6-(3,4-dimethoxyphenyl)-1-((methylthio)methyl)-
RN: 115765-00-9
InChIKey: HLGKYSNIPGJMBD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H19-Cl-N4-O2-S

Molecular Weight

  • 414.9151
 
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Names and Synonyms

Synonyms

  • 8-Chloro-6-(3,4-dimethoxyphenyl)-1-(methylthiomethyl)-4H-5-triazolo(4,3-a)-1,4-benzodiazepine
  • BRN 4590495

Systematic Name

  • 4H-(1,2,4)Triazolo(4,3-a)(1,4)benzodiazepine, 8-chloro-6-(3,4-dimethoxyphenyl)-1-((methylthio)methyl)-

Registry Numbers

CAS Registry Number

  • 115765-00-9

System Generated Number

  • 0115765009

Structure Descriptors

InChI

1S/C20H19ClN4O2S/c1-26-16-7-4-12(8-17(16)27-2)20-14-9-13(21)5-6-15(14)25-18(10-22-20)23-24-19(25)11-28-3/h4-9H,10-11H2,1-3H3

InChIKey

HLGKYSNIPGJMBD-UHFFFAOYSA-N

Smiles

COc1ccc(cc1OC)C2=NCc3nnc(CSC)n3c4ccc(Cl)cc24

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 2500mg/kg (2500mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 53, Pg. 361, 1988.