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Substance Name: Piperazine, 1-(7-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-4-methyl-, maleate (1:1)
RN: 4789-67-7
InChIKey: NJPWHORDIXYGGX-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-(7-Chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-4-methylpiperazine maleate

Systematic Name

  • Piperazine, 1-(7-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-4-methyl-, maleate (1:1)

Registry Numbers

CAS Registry Number

  • 4789-67-7

System Generated Number

  • 0004789677

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

InChIKey

NJPWHORDIXYGGX-BTJKTKAUSA-N

Smiles

N1([C@@H]2Cc3ccccc3Sc3c2ccc(c3)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 94mg/kg (94mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 33, Pg. 1852, 1968.