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Substance Name: Piperazine, 1-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-4-ethyl-, maleate (1:1)
RN: 4789-62-2
InChIKey: NVSSBIXBPOFLAW-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H24-N2-S.C4-H4-O4

Molecular Weight

  • 440.561
 
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Names and Synonyms

Synonyms

  • 1-(10,11-Dihydrodibenzo(b,f)thiepin-10-yl)-4-ethylpiperazine maleate
  • 10-(4-Ethylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin maleate

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 4789-62-2

System Generated Number

  • 0004789622

Molecular Formulas

Molecular Formula

  • C20-H24-N2-S.C4-H4-O4

Molecular Formula Fragments

  • C20-H24-N2-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C20H24N2S.C4H4O4/c1-2-21-11-13-22(14-12-21)18-15-16-7-3-5-9-19(16)23-20-10-6-4-8-17(18)20;5-3(6)1-2-4(7)8/h3-10,18H,2,11-15H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

NVSSBIXBPOFLAW-WLHGVMLRSA-N

Smiles

C(\C=C\C(O)=O)(=O)O.N1(CCN(CC1)CC)[C@@H]1Cc2c(Sc3c1cccc3)cccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 15mg/kg (15mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 32, Pg. 3186, 1967.