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Substance Name: Piperazine, 1-(2-((6,11-dihydro-2-methyldibenzo(b,e)thiepin-11-yl)oxy)ethyl)-4-methyl-, (Z)-2-butenedioate (1:2)
RN: 96122-28-0
InChIKey: RPSQYKKWXSCSII-SPIKMXEPSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H28-N2-O-S.2C4-H4-O4

Molecular Weight

  • 600.6854
 
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Names and Synonyms

Synonym

  • 2-Methyl-11-(2-(4-methylpiperazino)ethoxy)-6,11-dihydrodibenzo(b,e)thiepin bis(maleate)

Systematic Name

  • Piperazine, 1-(2-((6,11-dihydro-2-methyldibenzo(b,e)thiepin-11-yl)oxy)ethyl)-4-methyl-, (Z)-2-butenedioate (1:2)

Registry Numbers

CAS Registry Number

  • 96122-28-0

System Generated Number

  • 0096122280

Molecular Formulas

Molecular Formula

  • C22-H28-N2-O-S.2C4-H4-O4

Molecular Formula Fragments

  • C22-H28-N2-O-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C22H28N2OS.2C4H4O4/c1-17-7-8-21-20(15-17)22(19-6-4-3-5-18(19)16-26-21)25-14-13-24-11-9-23(2)10-12-24;2*5-3(6)1-2-4(7)8/h3-8,15,22H,9-14,16H2,1-2H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-

InChIKey

RPSQYKKWXSCSII-SPIKMXEPSA-N

Smiles

C(=O)(/C=C\C(=O)O)O.N1(CCN(CC1)C)CCOC1c2c(SCc3c1cccc3)ccc(c2)C.C(=O)(/C=C\C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2445mg/kg (2445mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Collection of Czechoslovak Chemical Communications. Vol. 49, Pg. 2520, 1984.