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Substance Name: 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-2,2-dibutylthio-9,10-dimethoxy-3-(2-methylpropyl)-, hydrochloride
RN: 18065-98-0
InChIKey: MFRNLPMKEAVLBB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H45-N-O2-S2.Cl-H

Molecular Weight

  • 532.249
 
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Names and Synonyms

  • 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-2,2-dibutylthio-9,10-dimethoxy-3-(2-methylpropyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 18065-98-0

System Generated Number

  • 0018065980

Molecular Formulas

Molecular Formula

  • C27-H45-N-O2-S2.Cl-H

Molecular Formula Fragments

  • C27-H45-N-O2-S2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C27H45NO3S2.ClH/c1-7-9-11-20-21(12-10-8-2)28-17-19(13-18(3)4)22(29)14-25(28)27(33)16-24(31-6)23(30-5)15-26(20,27)32;/h15-16,18-21,25,32-33H,7-14,17H2,1-6H3;1H

InChIKey

MFRNLPMKEAVLBB-UHFFFAOYSA-N

Smiles

C1[N@@]2[C@@H]([C@@H]([C@@]3([C@@]([C@@H]2CC([C@@H]1CC(C)C)=O)(C=C(C(=C3)OC)OC)S)S)CCCC)CCCC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS Journal of Medicinal Chemistry. Vol. 10, Pg. 1183, 1967.
mouse LD50 oral 500mg/kg (500mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS Journal of Medicinal Chemistry. Vol. 10, Pg. 1183, 1967.