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Substance Name: Piperazine, 1-(2-chloro-10,11-dihydro-7-fluorodibenzo(b,f)thiepin-10-yl)-4-methyl-, monomethanesulfonate
RN: 58722-66-0
InChIKey: QFLLCXHXIPCVAE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H20-Cl-F-N2-S.C-H4-O3-S

Molecular Weight

  • 459.0036
 
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Names and Synonyms

Synonym

  • 2-Chloro-7-fluoro-10-(4-methylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin methanesulfonate

Systematic Name

  • Piperazine, 1-(2-chloro-10,11-dihydro-7-fluorodibenzo(b,f)thiepin-10-yl)-4-methyl-, monomethanesulfonate

Registry Numbers

CAS Registry Number

  • 58722-66-0

System Generated Number

  • 0058722660

Molecular Formulas

Molecular Formula

  • C19-H20-Cl-F-N2-S.C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C19-H20-Cl-F-N2-S
  • COMPONENT

Structure Descriptors

InChI

1S/C19H20ClFN2S.CH4O3S/c1-22-6-8-23(9-7-22)17-11-13-10-14(20)2-5-18(13)24-19-12-15(21)3-4-16(17)19;1-5(2,3)4/h2-5,10,12,17H,6-9,11H2,1H3;1H3,(H,2,3,4)

InChIKey

QFLLCXHXIPCVAE-UHFFFAOYSA-N

Smiles

CN1CCN(CC1)C2Cc3cc(ccc3Sc4c2ccc(c4)F)Cl.CS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 280mg/kg (280mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Collection of Czechoslovak Chemical Communications. Vol. 40, Pg. 2887, 1975.