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Substance Name: Piperazine, 1-(4-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-4-methyl-, maleate (1:1)
RN: 13956-72-4
InChIKey: QPFKBZQLTKZWFA-BTJKTKAUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H21-Cl-N2-S.C4-H4-O4

Molecular Weight

  • 460.979
 
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Names and Synonyms

Synonym

  • 1-(4-Chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-4-methylpiperazine maleate

Systematic Name

  • Piperazine, 1-(4-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-4-methyl-, maleate (1:1)

Registry Numbers

CAS Registry Number

  • 13956-72-4

System Generated Number

  • 0013956724

Molecular Formulas

Molecular Formula

  • C19-H21-Cl-N2-S.C4-H4-O4

Molecular Formula Fragments

  • C19-H21-Cl-N2-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C19H21ClN2S.C4H4O4/c1-21-9-11-22(12-10-21)17-13-14-5-4-7-16(20)19(14)23-18-8-3-2-6-15(17)18;5-3(6)1-2-4(7)8/h2-8,17H,9-13H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

QPFKBZQLTKZWFA-BTJKTKAUSA-N

Smiles

N1([C@@H]2Cc3cccc(c3Sc3c2cccc3)Cl)CCN(CC1)C.C(\C=C/C(=O)O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 67mg/kg (67mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 33, Pg. 1852, 1968.