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Substance Name: Piperazine, 1-(8-chloro-3,7-dimethoxydibenzo(b,f)thiepin-10-yl)-4-methyl-, (Z)-2-butenedioate (1:1)
RN: 61150-35-4
InChIKey: BDXSKFDEWDHXNG-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H23-Cl-N2-O2-S.C4-H4-O4

Molecular Weight

  • 519.0153
 
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Names and Synonyms

Synonyms

  • 8-Chloro-3,7-dimethoxy-10-(4-methylpiperazino)dibenzo(b,f)thiepin maleate
  • VUFB-10701

Systematic Name

  • Piperazine, 1-(8-chloro-3,7-dimethoxydibenzo(b,f)thiepin-10-yl)-4-methyl-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 61150-35-4

System Generated Number

  • 0061150354

Molecular Formulas

Molecular Formula

  • C21-H23-Cl-N2-O2-S.C4-H4-O4

Molecular Formula Fragments

  • C21-H23-Cl-N2-O2-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C21H23ClN2O2S.C4H4O4/c1-23-6-8-24(9-7-23)18-10-14-4-5-15(25-2)11-20(14)27-21-13-19(26-3)17(22)12-16(18)21;5-3(6)1-2-4(7)8/h4-5,10-13H,6-9H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

BDXSKFDEWDHXNG-WLHGVMLRSA-N

Smiles

CN1CCN(CC1)C2=Cc3ccc(cc3Sc4c2cc(c(c4)OC)Cl)OC.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 464mg/kg (464mg/kg) BEHAVIORAL: ATAXIA Collection of Czechoslovak Chemical Communications. Vol. 42, Pg. 1179, 1977.