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Substance Name: 1-Piperazinepropanol, 4-(8-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-, 1-oxide, dihydrochloride
RN: 32859-69-1
InChIKey: CYCWFIBOOALSDS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H25-Cl-N2-O2-S.2Cl-H

Molecular Weight

  • 477.881
 
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Names and Synonyms

Synonyms

  • 4-(8-Chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-1-piperazinepropanol 1-oxide 2HCl
  • Oxyclothepin N-oxide dihydrochloride

Systematic Name

  • 1-Piperazinepropanol, 4-(8-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-, 1-oxide, dihydrochloride

Registry Numbers

CAS Registry Number

  • 32859-69-1

System Generated Number

  • 0032859691

Molecular Formulas

Molecular Formula

  • C21-H25-Cl-N2-O2-S.2Cl-H

Molecular Formula Fragments

  • C21-H25-Cl-N2-O2-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H25ClN2O2S.2ClH/c22-17-6-7-21-18(15-17)19(14-16-4-1-2-5-20(16)27-21)23-8-11-24(26,12-9-23)10-3-13-25;;/h1-2,4-7,15,19,25H,3,8-14H2;2*1H

InChIKey

CYCWFIBOOALSDS-UHFFFAOYSA-N

Smiles

C1N(CCCO)(=O)CCN([C@@H]2Cc3c(Sc4c2cc(cc4)Cl)cccc3)C1.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 94400ug/kg (94.4mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 41, Pg. 443, 1976.