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Substance Name: Piperazine, 1-(10,11-dihydro-2-methoxydibenzo(b,f)thiepin-10-yl)-4-methyl-, dimethanesulfonate
RN: 57536-76-2
InChIKey: DWFRLZZQEWVBTC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H24-N2-O-S.2C-H4-O3-S

Molecular Weight

  • 532.6998
 
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Names and Synonyms

Synonyms

  • 2-Methoxy-10-(4-methylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin dimethanesulfonate
  • VUFB-12285

Systematic Name

  • Piperazine, 1-(10,11-dihydro-2-methoxydibenzo(b,f)thiepin-10-yl)-4-methyl-, dimethanesulfonate

Registry Numbers

CAS Registry Number

  • 57536-76-2

System Generated Number

  • 0057536762

Molecular Formulas

Molecular Formula

  • C20-H24-N2-O-S.2C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C20-H24-N2-O-S
  • COMPONENT

Structure Descriptors

InChI

1S/C20H24N2OS.2CH4O3S/c1-21-9-11-22(12-10-21)18-14-15-13-16(23-2)7-8-19(15)24-20-6-4-3-5-17(18)20;2*1-5(2,3)4/h3-8,13,18H,9-12,14H2,1-2H3;2*1H3,(H,2,3,4)

InChIKey

DWFRLZZQEWVBTC-UHFFFAOYSA-N

Smiles

CN1CCN(CC1)C2Cc3cc(ccc3Sc4c2cccc4)OC.CS(=O)(=O)O.CS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 150mg/kg (150mg/kg) BEHAVIORAL: ATAXIA Collection of Czechoslovak Chemical Communications. Vol. 40, Pg. 1940, 1975.