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Substance Name: 3,7-Diazabicyclo(3.3.1)nonane, 3-butyl-7-((2-chloro-6-methylphenyl)sulfonyl)-9,9-dimethyl-
RN: 120465-91-0
InChIKey: NCDGANIYDBIHML-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H31-Cl-N2-O2-S

Molecular Weight

  • 398.9959
 
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Names and Synonyms

Synonym

  • 3-Butyl-7-((2-chloro-6-methylphenyl)sulfonyl)-9,9-dimethyl-3,7-diazabicyclo(3.3.1)nonane

Systematic Name

  • 3,7-Diazabicyclo(3.3.1)nonane, 3-butyl-7-((2-chloro-6-methylphenyl)sulfonyl)-9,9-dimethyl-

Registry Numbers

CAS Registry Number

  • 120465-91-0

System Generated Number

  • 0120465910

Structure Descriptors

InChI

1S/C20H31ClN2O2S/c1-5-6-10-22-11-16-13-23(14-17(12-22)20(16,3)4)26(24,25)19-15(2)8-7-9-18(19)21/h7-9,16-17H,5-6,10-14H2,1-4H3

InChIKey

NCDGANIYDBIHML-UHFFFAOYSA-N

Smiles

CCCCN1CC2CN(CC(C1)C2(C)C)S(=O)(=O)c3c(cccc3Cl)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 200mg/kg (200mg/kg)   United States Patent Document. Vol. #4906640,