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Substance Name: Piperazine, 4-(10,11-dihydro-8-(methylthio)dibenzo(b,f)thiepin-10-yl)-1,2-dimethyl-, (Z)-2-butenedioate (1:1)
RN: 61015-13-2
InChIKey: FPHFHBGUAGNKBU-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H26-N2-S2.C4-H4-O4

Molecular Weight

  • 486.654
 
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Names and Synonyms

Synonyms

  • 10-(3,4-Dimethylpiperazino)-8-methylthio-10,11-dihydrodibenzo(b,f)thiepin maleate
  • 4-(10,11-Dihydro-8-(methylthio)dibenzo(b,f)thiepin-10-yl)-1,2-dimethylpiperazine maleate

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 61015-13-2

System Generated Number

  • 0061015132

Molecular Formulas

Molecular Formula

  • C21-H26-N2-S2.C4-H4-O4

Molecular Formula Fragments

  • C21-H26-N2-S2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C21H26N2S2.C4H4O4/c1-15-14-23(11-10-22(15)2)19-12-16-6-4-5-7-20(16)25-21-9-8-17(24-3)13-18(19)21;5-3(6)1-2-4(7)8/h4-9,13,15,19H,10-12,14H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

FPHFHBGUAGNKBU-WLHGVMLRSA-N

Smiles

CC1CN(CCN1C)C2Cc3ccccc3Sc4c2cc(cc4)SC.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 144mg/kg (144mg/kg) BEHAVIORAL: ATAXIA Collection of Czechoslovak Chemical Communications. Vol. 41, Pg. 910, 1976.