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Substance Name: Dibenzo(b,f)thiepin-10(11H)-one, 6-(2-(methylamino)ethoxy)-, hydrochloride
RN: 125981-95-5
InChIKey: KZMBCYNRMLTXGP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H17-N-O2-S.Cl-H

Molecular Weight

  • 335.8532
 
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Names and Synonyms

Synonym

  • 6-(2-Methylaminoethoxy)dibenzo(b,f)thiepin-10(11H)-one hydrochloride

Systematic Name

  • Dibenzo(b,f)thiepin-10(11H)-one, 6-(2-(methylamino)ethoxy)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 125981-95-5

System Generated Number

  • 0125981955

Molecular Formulas

Molecular Formula

  • C17-H17-N-O2-S.Cl-H

Molecular Formula Fragments

  • C17-H17-N-O2-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H17NO2S.ClH/c1-18-9-10-20-15-7-4-6-13-14(19)11-12-5-2-3-8-16(12)21-17(13)15;/h2-8,18H,9-11H2,1H3;1H

InChIKey

KZMBCYNRMLTXGP-UHFFFAOYSA-N

Smiles

CNCCOc1cccc2c1Sc3ccccc3CC2=O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 71571ug/kg (71.571mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 54, Pg. 1955, 1989.