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Substance Name: Ethanone, 1-phenyl-2-(2-pyridinylthio)-, hydrobromide
RN: 3166-30-1
InChIKey: ZDMLUKJLNPFJKW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H11-N-O-S.Br-H

Molecular Weight

  • 310.214
 
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Names and Synonyms

Synonyms

  • 1-Phenyl-2-(2-pyridinylthio)ethanone hydrobromide
  • 2-Benzylmethylthiopyridine hydrobromide

Systematic Name

  • Ethanone, 1-phenyl-2-(2-pyridinylthio)-, hydrobromide

Registry Numbers

CAS Registry Number

  • 3166-30-1

System Generated Number

  • 0003166301

Molecular Formulas

Molecular Formula

  • C13-H11-N-O-S.Br-H

Molecular Formula Fragments

  • Br-H
  • C13-H11-N-O-S
  • COMPONENT

Structure Descriptors

InChI

1S/C13H11NOS.BrH/c15-12(11-6-2-1-3-7-11)10-16-13-8-4-5-9-14-13;/h1-9H,10H2;1H

InChIKey

ZDMLUKJLNPFJKW-UHFFFAOYSA-N

Smiles

C(CSc1ccccn1)(c1ccccc1)=O.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 135mg/kg (135mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 240, 1991.