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Substance Name: Propanedinitrile, ((methylamino)((2-(((5-(1-piperidinylmethyl)-2-furanyl)methyl)amino)ethyl)amino)methylene)-, hydrochloride, hydrate (1:2:1)
RN: 135017-76-4
InChIKey: OZGBKPUJRIBSCO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H26-N6-O.2Cl-H.H2-O

Molecular Weight

  • 415.3662
 
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Names and Synonyms

  • Propanedinitrile, ((methylamino)((2-(((5-(1-piperidinylmethyl)-2-furanyl)methyl)amino)ethyl)amino)methylene)-, hydrochloride, hydrate (1:2:1)

Registry Numbers

CAS Registry Number

  • 135017-76-4

System Generated Number

  • 0135017764

Molecular Formulas

Molecular Formula

  • C18-H26-N6-O.2Cl-H.H2-O

Molecular Formula Fragments

  • C18-H26-N6-O
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C18H26N6O.2ClH/c1-21-18(15(11-19)12-20)23-8-7-22-13-16-5-6-17(25-16)14-24-9-3-2-4-10-24;;/h5-6,21-23H,2-4,7-10,13-14H2,1H3;2*1H

InChIKey

OZGBKPUJRIBSCO-UHFFFAOYSA-N

Smiles

CNC(=C(C#N)C#N)NCCNCc1ccc(o1)CN2CCCCC2.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,