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Substance Name: 1-Piperazineethanol, 4-(2-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-, S,1-dioxide
RN: 73225-76-0
InChIKey: OCIFGRNVUJBEKO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H23-Cl-N2-O3-S

Molecular Weight

  • 406.9317
 
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Names and Synonyms

Synonyms

  • BRN 0849719
  • Docloxythepin N,S-dioxide

Systematic Name

  • 1-Piperazineethanol, 4-(2-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-, S,1-dioxide

Registry Numbers

CAS Registry Number

  • 73225-76-0

System Generated Number

  • 0073225760

Structure Descriptors

InChI

1S/C20H23ClN2O3S/c21-16-5-6-19-15(13-16)14-18(17-3-1-2-4-20(17)27(19)26)22-7-9-23(25,10-8-22)11-12-24/h1-6,13,18,24H,7-12,14H2

InChIKey

OCIFGRNVUJBEKO-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)C(Cc3cc(ccc3S2=O)Cl)N4CC[N+](CC4)(CCO)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 80mg/kg (80mg/kg) BEHAVIORAL: ATAXIA Collection of Czechoslovak Chemical Communications. Vol. 44, Pg. 3008, 1979.