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Substance Name: Piperazine, 1-(10,11-dihydro-8-(methylsulfinyl)dibenzo(b,f)thiepin-10-yl)-4-methyl-, (Z)-2-butenedioate (1:1)
RN: 41931-88-8
InChIKey: QSDYCMVSZROZQR-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H24-N2-O-S2.C4-H4-O4

Molecular Weight

  • 488.6262
 
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Names and Synonyms

Synonym

  • 1-(10,11-Dihydro-8-(methylsulfinyl)dibenzo(b,f)thiepin-10-yl)-4-methylpiperazine maleate

Systematic Name

  • Piperazine, 1-(10,11-dihydro-8-(methylsulfinyl)dibenzo(b,f)thiepin-10-yl)-4-methyl-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 41931-88-8

System Generated Number

  • 0041931888

Molecular Formulas

Molecular Formula

  • C20-H24-N2-O-S2.C4-H4-O4

Molecular Formula Fragments

  • C20-H24-N2-O-S2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C20H24N2OS2.C4H4O4/c1-21-9-11-22(12-10-21)18-13-15-5-3-4-6-19(15)24-20-8-7-16(25(2)23)14-17(18)20;5-3(6)1-2-4(7)8/h3-8,14,18H,9-13H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

QSDYCMVSZROZQR-WLHGVMLRSA-N

Smiles

CN1CCN(CC1)C2Cc3ccccc3Sc4c2cc(cc4)S(=O)C.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 13400ug/kg (13.4mg/kg) BEHAVIORAL: ATAXIA Collection of Czechoslovak Chemical Communications. Vol. 38, Pg. 599, 1973.