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Substance Name: Thioxanthene, 7-bromo-2-chloro-9-(3-(4-(2-hydroxyethyl)piperazinyl)propylidene)-, dihydrochloride
RN: 64047-93-4
InChIKey: TUTHZCGVRIGJOK-HABIVSBTSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H24-Br-Cl-N2-O-S.2Cl-H

Molecular Weight

  • 552.789
 
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Names and Synonyms

Synonyms

  • 1-Piperazineethanol, 4-(3-(2-chloro-7-bromothioxanth-9-ylidene)propyl)-, dihydrochloride
  • N 769

Systematic Name

  • Thioxanthene, 7-bromo-2-chloro-9-(3-(4-(2-hydroxyethyl)piperazinyl)propylidene)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 64047-93-4

System Generated Number

  • 0064047934

Molecular Formulas

Molecular Formula

  • C22-H24-Br-Cl-N2-O-S.2Cl-H

Molecular Formula Fragments

  • C22-H24-Br-Cl-N2-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H24BrClN2OS.2ClH/c23-16-3-5-21-19(14-16)18(20-15-17(24)4-6-22(20)28-21)2-1-7-25-8-10-26(11-9-25)12-13-27;;/h2-6,14-15,27H,1,7-13H2;2*1H/b18-2-;;

InChIKey

TUTHZCGVRIGJOK-HABIVSBTSA-N

Smiles

C1(\c2c(ccc(c2)Cl)Sc2c1cc(cc2)Br)=C/CCN1CCN(CC1)CCO.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 87mg/kg (87mg/kg) BEHAVIORAL: SLEEP Acta Pharmacologica et Toxicologica. Vol. 19, Pg. 87, 1962.