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Substance Name: Piperazine, 1-(2-chloro-8-fluorodibenzo(b,f)thiepin-10-yl)-4-methyl-, (Z)-2-butenedioate (1:1)
RN: 58722-77-3
InChIKey: PUJKYFHLFGUEED-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H18-Cl-F-N2-S.C4-H4-O4

Molecular Weight

  • 476.9538
 
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Names and Synonyms

Synonym

  • 1-(2-Chloro-8-fluorodibenzo(b,f)thiepin-10-yl)-4-methylpiperazine maleate

Systematic Name

  • Piperazine, 1-(2-chloro-8-fluorodibenzo(b,f)thiepin-10-yl)-4-methyl-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 58722-77-3

System Generated Number

  • 0058722773

Molecular Formulas

Molecular Formula

  • C19-H18-Cl-F-N2-S.C4-H4-O4

Molecular Formula Fragments

  • C19-H18-Cl-F-N2-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C19H18ClFN2S.C4H4O4/c1-22-6-8-23(9-7-22)17-11-13-10-14(20)2-4-18(13)24-19-5-3-15(21)12-16(17)19;5-3(6)1-2-4(7)8/h2-5,10-12H,6-9H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

PUJKYFHLFGUEED-WLHGVMLRSA-N

Smiles

CN1CCN(CC1)C2=Cc3cc(ccc3Sc4c2cc(cc4)F)Cl.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 168mg/kg (168mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: REGIDITY

BEHAVIORAL: ATAXIA
Collection of Czechoslovak Chemical Communications. Vol. 40, Pg. 2887, 1975.