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Substance Name: 1,2-Ethanediamine, N,N-bis(1-methylethyl)-N'-(6-methoxy-5-(methylthio)-2-(1-piperidinyl)-4-pyrimidinyl)-, monohydrobromide
RN: 55417-16-8
InChIKey: YLGZTLKZVOSIRN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H35-N5-O-S.Br-H

Molecular Weight

  • 462.4974
 
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Names and Synonyms

  • 1,2-Ethanediamine, N,N-bis(1-methylethyl)-N'-(6-methoxy-5-(methylthio)-2-(1-piperidinyl)-4-pyrimidinyl)-, monohydrobromide

Registry Numbers

CAS Registry Number

  • 55417-16-8

System Generated Number

  • 0055417168

Molecular Formulas

Molecular Formula

  • C19-H35-N5-O-S.Br-H

Molecular Formula Fragments

  • Br-H
  • C19-H35-N5-O-S
  • COMPONENT

Structure Descriptors

InChI

1S/C19H35N5OS.BrH/c1-14(2)24(15(3)4)13-10-20-17-16(26-6)18(25-5)22-19(21-17)23-11-8-7-9-12-23;/h14-15H,7-13H2,1-6H3,(H,20,21,22);1H

InChIKey

YLGZTLKZVOSIRN-UHFFFAOYSA-N

Smiles

CC(C)N(CCNc1c(c(nc(n1)N2CCCCC2)OC)SC)C(C)C.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 200mg/kg (200mg/kg)   United States Patent Document. Vol. #3968214,