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Substance Name: Benzeneethanamine, 2-((4-methoxyphenyl)thio)-N,alpha-dimethyl-, hydrochloride
RN: 128959-25-1
InChIKey: JUGXPWVKURHMFI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H21-N-O-S.Cl-H

Molecular Weight

  • 323.8858
 
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Names and Synonyms

Synonyms

  • 2-((4-Methoxyphenyl)thio)-N,alpha-dimethylbenzeneethanamine hydrochloride
  • N-Methyl-1-(2-(4-methoxyphenylthio)phenyl)-2-propylamine hydrochloride

Systematic Name

  • Benzeneethanamine, 2-((4-methoxyphenyl)thio)-N,alpha-dimethyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 128959-25-1

System Generated Number

  • 0128959251

Molecular Formulas

Molecular Formula

  • C17-H21-N-O-S.Cl-H

Molecular Formula Fragments

  • C17-H21-N-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H21NOS.ClH/c1-13(18-2)12-14-6-4-5-7-17(14)20-16-10-8-15(19-3)9-11-16;/h4-11,13,18H,12H2,1-3H3;1H

InChIKey

JUGXPWVKURHMFI-UHFFFAOYSA-N

Smiles

CC(Cc1ccccc1Sc2ccc(cc2)OC)NC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 28mg/kg (28mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 55, Pg. 1077, 1990.
mouse LD50 oral 361mg/kg (361mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 55, Pg. 1077, 1990.