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Substance Name: Ethanone, 2-(methyl(phenylmethyl)amino)-1-(4-(methylsulfonyl)phenyl)-, hydrochloride
RN: 56621-60-4
InChIKey: HLGBQPFMMPGBOM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H19-N-O3-S.Cl-H

Molecular Weight

  • 353.868
 
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Names and Synonyms

Synonym

  • 2-(Methyl(phenylmethyl)amino)-1-(4-(methylsulfonyl)phenyl)ethanone hydrochloride

Systematic Name

  • Ethanone, 2-(methyl(phenylmethyl)amino)-1-(4-(methylsulfonyl)phenyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 56621-60-4

System Generated Number

  • 0056621604

Molecular Formulas

Molecular Formula

  • C17-H19-N-O3-S.Cl-H

Molecular Formula Fragments

  • C17-H19-N-O3-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H19NO3S.ClH/c1-18(12-14-6-4-3-5-7-14)13-17(19)15-8-10-16(11-9-15)22(2,20)21;/h3-11H,12-13H2,1-2H3;1H

InChIKey

HLGBQPFMMPGBOM-UHFFFAOYSA-N

Smiles

c1(ccc(S(C)(=O)=O)cc1)C(C[N@@H+](Cc1ccccc1)C)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1500mg/kg (1500mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: EXCITEMENT
Collection of Czechoslovak Chemical Communications. Vol. 40, Pg. 1204, 1975.