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Substance Name: Dibenzo(b,f)thiepin-10(11H)-one, 6-(3-(dimethylamino)propoxy)-, hydrochloride
RN: 125981-92-2
InChIKey: LWOMGTZTRHYNEO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H21-N-O2-S.Cl-H

Molecular Weight

  • 363.9068
 
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Names and Synonyms

Synonym

  • 6-(3-Dimethylaminopropoxy)dibenzo(b,f)thiepin-10(11H)-one hydrochloride

Systematic Name

  • Dibenzo(b,f)thiepin-10(11H)-one, 6-(3-(dimethylamino)propoxy)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 125981-92-2

System Generated Number

  • 0125981922

Molecular Formulas

Molecular Formula

  • C19-H21-N-O2-S.Cl-H

Molecular Formula Fragments

  • C19-H21-N-O2-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C19H21NO2S.ClH/c1-20(2)11-6-12-22-17-9-5-8-15-16(21)13-14-7-3-4-10-18(14)23-19(15)17;/h3-5,7-10H,6,11-13H2,1-2H3;1H

InChIKey

LWOMGTZTRHYNEO-UHFFFAOYSA-N

Smiles

CN(C)CCCOc1cccc2c1Sc3ccccc3CC2=O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 33230ug/kg (33.23mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 54, Pg. 1955, 1989.
mouse LD50 oral 360mg/kg (360mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 54, Pg. 1955, 1989.