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Substance Name: Dibenzo(c,e)thiepinium, 5,7-dihydro-6-methyl-, iodide
RN: 109561-74-2
InChIKey: UNBVHIYMNJSDBI-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H15-S.I

Molecular Weight

  • 354.25
 
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Names and Synonyms

Synonyms

  • 5,7-Dihydro-6-methyldibenzo(c,e)thiepinium iodide
  • 6-Methyl-5,7-dihydrodibenzo(c,e)thiepinium iodide

Systematic Name

  • Dibenzo(c,e)thiepinium, 5,7-dihydro-6-methyl-, iodide

Registry Numbers

CAS Registry Number

  • 109561-74-2

System Generated Number

  • 0109561742

Molecular Formulas

Molecular Formula

  • C15-H15-S.I

Molecular Formula Fragments

  • C15-H15-S
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C15H15S.HI/c1-16-10-12-6-2-4-8-14(12)15-9-5-3-7-13(15)11-16;/h2-9H,10-11H2,1H3;1H/q+1;/p-1

InChIKey

UNBVHIYMNJSDBI-UHFFFAOYSA-M

Smiles

c12c3c(C[S+](Cc1cccc2)C)cccc3.[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 4mg/kg (4mg/kg) VASCULAR: BP LOWERING NOT CHARACTERIZED IN AUTONOMIC SECTION Collection of Czechoslovak Chemical Communications. Vol. 51, Pg. 2848, 1986.