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Substance Name: Ethanol, 2,2'-((8-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)imino)bis-, (Z)-2-butenedioate (1:1)
RN: 34770-84-8
InChIKey: PWJITRRIECTTPS-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H20-Cl-N-O2-S.C4-H4-O4

Molecular Weight

  • 465.952
 
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Names and Synonyms

Synonyms

  • 2,2'-((8-Chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)imino)bisethanol maleate
  • 8-Chloro-10-(bis(2-hydroxyethyl)amino)-10,11-dihydrodibenzo(b,f)thiepin hydrogen maleate

Systematic Name

  • Ethanol, 2,2'-((8-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)imino)bis-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 34770-84-8

System Generated Number

  • 0034770848

Molecular Formulas

Molecular Formula

  • C18-H20-Cl-N-O2-S.C4-H4-O4

Molecular Formula Fragments

  • C18-H20-Cl-N-O2-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C18H20ClNO2S.C4H4O4/c19-14-5-6-18-15(12-14)16(20(7-9-21)8-10-22)11-13-3-1-2-4-17(13)23-18;5-3(6)1-2-4(7)8/h1-6,12,16,21-22H,7-11H2;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

PWJITRRIECTTPS-WLHGVMLRSA-N

Smiles

N([C@@H]1Cc2c(Sc3ccc(cc13)Cl)cccc2)(CCO)CCO.C(\C=C\C(=O)O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 200mg/kg (200mg/kg) BEHAVIORAL: ATAXIA Collection of Czechoslovak Chemical Communications. Vol. 36, Pg. 2226, 1971.