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Substance Name: Piperazine, 1-(10,11-dihydro-7-methyldibenzo(b,f)thiepin-10-yl)-4-methyl-, monomethanesulfonate
RN: 84964-83-0
InChIKey: WPCWKHOGHHGQSW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H24-N2-S.C-H4-O3-S

Molecular Weight

  • 420.5952
 
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Names and Synonyms

Synonyms

  • 1-(10,11-Dihydro-7-methyldibenzo(b,f)thiepin-10-yl)-4-methylpiperazine methanesulfonate
  • 3-Methyl-11-(4-methylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin monomethanesulfonate

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 84964-83-0

System Generated Number

  • 0084964830

Molecular Formulas

Molecular Formula

  • C20-H24-N2-S.C-H4-O3-S

Molecular Formula Fragments

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

Structure Descriptors

InChI

1S/C20H24N2S.CH4O3S/c1-15-7-8-17-18(22-11-9-21(2)10-12-22)14-16-5-3-4-6-19(16)23-20(17)13-15;1-5(2,3)4/h3-8,13,18H,9-12,14H2,1-2H3;1H3,(H,2,3,4)

InChIKey

WPCWKHOGHHGQSW-UHFFFAOYSA-N

Smiles

Cc1ccc2c(c1)Sc3ccccc3CC2N4CCN(CC4)C.CS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 48600ug/kg (48.6mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 47, Pg. 3134, 1982.