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Substance Name: Benzo(b)cyclohepta(e)(1,4)thiazine, 5a,6,7,8,9,10,10a,11-octahydro-11-(2-(dimethylamino)ethyl)-2-trifluoromethyl-, hydrochloride
RN: 54969-10-7
InChIKey: WUTYMJMKSLYYND-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H25-F3-N2-S.Cl-H

Molecular Weight

  • 394.9304
 
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Names and Synonyms

  • Benzo(b)cyclohepta(e)(1,4)thiazine, 5a,6,7,8,9,10,10a,11-octahydro-11-(2-(dimethylamino)ethyl)-2-trifluoromethyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 54969-10-7

System Generated Number

  • 0054969107

Molecular Formulas

Molecular Formula

  • C18-H25-F3-N2-S.Cl-H

Molecular Formula Fragments

  • C18-H25-F3-N2-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H25F3N2S.ClH/c1-22(2)10-11-23-14-6-4-3-5-7-16(14)24-17-9-8-13(12-15(17)23)18(19,20)21;/h8-9,12,14,16H,3-7,10-11H2,1-2H3;1H

InChIKey

WUTYMJMKSLYYND-UHFFFAOYSA-N

Smiles

CN(C)CCN1c2cc(ccc2SC3C1CCCCC3)C(F)(F)F.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 93mg/kg (93mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 513, 1974.