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Substance Name: Dibenzo(b,f)thiepin-2,3-diol, 10,11-dihydro-10-amino-, hydrobromide
RN: 60969-94-0
InChIKey: OXQFSOUAVFMGNC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H13-N-O2-S.Br-H

Molecular Weight

  • 340.2396
 
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Names and Synonyms

Synonyms

  • 10,11-Dihydro-10-aminodibenzo(b,f)thiepin-2,3-diol hydrobromide
  • 10-Amino-2,3-dihydroxy-10,11-dihydrodibenzo(b,f)thiepin hydrobromide

Systematic Name

  • Dibenzo(b,f)thiepin-2,3-diol, 10,11-dihydro-10-amino-, hydrobromide

Registry Numbers

CAS Registry Number

  • 60969-94-0

System Generated Number

  • 0060969940

Molecular Formulas

Molecular Formula

  • C14-H13-N-O2-S.Br-H

Molecular Formula Fragments

  • Br-H
  • C14-H13-N-O2-S
  • COMPONENT

Structure Descriptors

InChI

1S/C14H13NO2S.BrH/c15-10-5-8-6-11(16)12(17)7-14(8)18-13-4-2-1-3-9(10)13;/h1-4,6-7,10,16-17H,5,15H2;1H

InChIKey

OXQFSOUAVFMGNC-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)C(Cc3cc(c(cc3S2)O)O)N.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 500mg/kg (500mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 41, Pg. 1396, 1976.