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Substance Name: Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride
RN: 135017-89-9
InChIKey: WLWSHUFNKHMUED-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H28-N6-O2.2Cl-H

Molecular Weight

  • 457.403
 
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Names and Synonyms

  • Propanedinitrile, (1-(2-(((5-((3-methoxy-1-piperidinyl)methyl)-2-furanyl)methyl)amino)ethyl)-2-imidazolidinylidene)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 135017-89-9

System Generated Number

  • 0135017899

Molecular Formulas

Molecular Formula

  • C20-H28-N6-O2.2Cl-H

Molecular Formula Fragments

  • C20-H28-N6-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H28N6O2.2ClH/c1-27-18-3-2-8-25(14-18)15-19-5-4-17(28-19)13-23-6-9-26-10-7-24-20(26)16(11-21)12-22;;/h4-5,18,23-24H,2-3,6-10,13-15H2,1H3;2*1H

InChIKey

WLWSHUFNKHMUED-UHFFFAOYSA-N

Smiles

COC1CCCN(C1)Cc2ccc(o2)CNCCN3CCNC3=C(C#N)C#N.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 300mg/kg (300mg/kg)   United States Patent Document. Vol. #5075301,