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Substance Name: 1-Propanamine, N,N-dimethyl-3-thieno(2,3-c)(2)benzothiepin-4(9H)-ylidene-, hydrochloride, (Z)-
RN: 42505-76-0
InChIKey: KTFGSVWWMYCIJB-ZTXYIFKNSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H19-N-S2.Cl-H

Molecular Weight

  • 337.937
 
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Names and Synonyms

Synonym

  • cis-Dithiaden hydrochloride

Systematic Name

  • 1-Propanamine, N,N-dimethyl-3-thieno(2,3-c)(2)benzothiepin-4(9H)-ylidene-, hydrochloride, (Z)-

Registry Numbers

CAS Registry Number

  • 42505-76-0

System Generated Number

  • 0042505760

Molecular Formulas

Molecular Formula

  • C17-H19-N-S2.Cl-H

Molecular Formula Fragments

  • C17-H19-N-S2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H19NS2.ClH/c1-18(2)10-5-8-15-14-7-4-3-6-13(14)12-20-17-16(15)9-11-19-17;/h3-4,6-9,11H,5,10,12H2,1-2H3;1H/b15-8-;

InChIKey

KTFGSVWWMYCIJB-ZTXYIFKNSA-N

Smiles

CN(C)CC/C=C\1/c2ccccc2CSc3c1ccs3.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 35900ug/kg (35.9mg/kg)   Cesko-Slovenska Farmacie. Vol. 20, Pg. 251, 1971.
mouse LD50 oral 1020mg/kg (1020mg/kg)   Cesko-Slovenska Farmacie. Vol. 20, Pg. 251, 1971.