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Substance Name: Piperazine, 1-(8-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-4-(1,1-dimethylethyl)-, dimethanesulfonate
RN: 61015-01-8
InChIKey: FPRACIYHCLGSES-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H27-Cl-N2-S.2C-H4-O3-S

Molecular Weight

  • 579.1995
 
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Names and Synonyms

Synonym

  • 10-(4-tert-Butylpiperazino)-8-chloro-10,11-dihydrodibenzo(b,f)thiepin bis(methanesulfonate)

Systematic Name

  • Piperazine, 1-(8-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-4-(1,1-dimethylethyl)-, dimethanesulfonate

Registry Numbers

CAS Registry Number

  • 61015-01-8

System Generated Number

  • 0061015018

Molecular Formulas

Molecular Formula

  • C22-H27-Cl-N2-S.2C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C22-H27-Cl-N2-S
  • COMPONENT

Structure Descriptors

InChI

1S/C22H27ClN2S.2CH4O3S/c1-22(2,3)25-12-10-24(11-13-25)19-14-16-6-4-5-7-20(16)26-21-9-8-17(23)15-18(19)21;2*1-5(2,3)4/h4-9,15,19H,10-14H2,1-3H3;2*1H3,(H,2,3,4)

InChIKey

FPRACIYHCLGSES-UHFFFAOYSA-N

Smiles

CC(C)(C)N1CCN(CC1)C2Cc3ccccc3Sc4c2cc(cc4)Cl.CS(=O)(=O)O.CS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 109mg/kg (109mg/kg) BEHAVIORAL: ATAXIA Collection of Czechoslovak Chemical Communications. Vol. 41, Pg. 910, 1976.