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Substance Name: Propiophenone, 2-(1-imidazolyl)-4'-(phenylthio)-, monohydrochloride
RN: 73932-20-4
InChIKey: NXKFBGSBEHRKAR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H16-N2-O-S.Cl-H

Molecular Weight

  • 344.8643
 
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Names and Synonyms

Synonym

  • 2-(1-Imidazolyl)-4'-(phenylthio)propiophenone monohydrochloride

Systematic Name

  • Propiophenone, 2-(1-imidazolyl)-4'-(phenylthio)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 73932-20-4

System Generated Number

  • 0073932204

Molecular Formulas

Molecular Formula

  • C18-H16-N2-O-S.Cl-H

Molecular Formula Fragments

  • C18-H16-N2-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H16N2OS.ClH/c1-14(20-12-11-19-13-20)18(21)15-7-9-17(10-8-15)22-16-5-3-2-4-6-16;/h2-14H,1H3;1H

InChIKey

NXKFBGSBEHRKAR-UHFFFAOYSA-N

Smiles

CC(C(=O)c1ccc(cc1)Sc2ccccc2)n3ccnc3.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 180mg/kg (180mg/kg)   Bollettino Chimico Farmaceutico. Vol. 120, Pg. 383, 1981.