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Substance Name: Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-11-(4-methyl-1-piperazinyl)-, maleate (1:1)
RN: 16946-50-2
InChIKey: DUGWDZBXNDONML-BTJKTKAUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H22-N2-O-S.C4-H4-O4

Molecular Weight

  • 442.533
 
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Names and Synonyms

Synonyms

  • 10,11-Dihydro-11-(4-methyl-1-piperazinyl)dibenzo(b,f)thiepin-10-ol maleate
  • 11-(4-Methylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin-10-ol maleate

Systematic Name

  • Dibenzo(b,f)thiepin-10-ol, 10,11-dihydro-11-(4-methyl-1-piperazinyl)-, maleate (1:1)

Registry Numbers

CAS Registry Number

  • 16946-50-2

System Generated Number

  • 0016946502

Molecular Formulas

Molecular Formula

  • C19-H22-N2-O-S.C4-H4-O4

Molecular Formula Fragments

  • C19-H22-N2-O-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C19H22N2OS.C4H4O4/c1-20-10-12-21(13-11-20)19(22)14-15-6-2-4-8-17(15)23-18-9-5-3-7-16(18)19;5-3(6)1-2-4(7)8/h2-9,22H,10-14H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

DUGWDZBXNDONML-BTJKTKAUSA-N

Smiles

N1([C@@]2(c3c(Sc4c(C2)cccc4)cccc3)O)CCN(CC1)C.C(\C=C/C(O)=O)(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 46200ug/kg (46.2mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 32, Pg. 3186, 1967.