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Substance Name: 2-Propen-1-amine, N-(3-dibenzo(b,e)thiepin-11(6H)-ylidenepropyl)-N-methyl-, hydrochloride, (E)-
RN: 85196-14-1
InChIKey: XDCSPPLDOICGQW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H23-N-S.Cl-H

Molecular Weight

  • 358.9545
 
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Names and Synonyms

Synonyms

  • (E)-11-(3-(N-Allyl-N-methylamino)propylidene)-6,11-dihydrodibenzo(b,e)thiepin hydrochloride
  • (E)-N-(3-Dibenzo(b,e)thiepin-11(6H)-ylidenepropyl)-N-methyl-2-propen-1-amine hydrochloride

Systematic Name

  • 2-Propen-1-amine, N-(3-dibenzo(b,e)thiepin-11(6H)-ylidenepropyl)-N-methyl-, hydrochloride, (E)-

Registry Numbers

CAS Registry Number

  • 85196-14-1

System Generated Number

  • 0085196141

Molecular Formulas

Molecular Formula

  • C21-H23-N-S.Cl-H

Molecular Formula Fragments

  • C21-H23-N-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H24NS.ClH/c1-3-14-22(2)15-8-12-19-18-10-5-4-9-17(18)16-23-21-13-7-6-11-20(19)21;/h3-7,9-13,21H,1,8,14-16H2,2H3;1H

InChIKey

XDCSPPLDOICGQW-UHFFFAOYSA-N

Smiles

CN(CCC=C1=C2C=CC=CC2SCc3c1cccc3)CC=C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 32290ug/kg (32.29mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Collection of Czechoslovak Chemical Communications. Vol. 48, Pg. 163, 1983.