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Substance Name: Urea, (((1,1-dimethylpropyl)amino)(3-pyridinylamino)methylene)-
RN: 67026-77-1
InChIKey: WBISBEQTZUMOHQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H19-N5-O

Molecular Weight

  • 249.3161
 
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Names and Synonyms

Synonyms

  • (((1,1-Dimethylpropyl)amino)(3-pyridinylamino)methylene)urea
  • BRN 0406057
  • Urea, ((tert-pentylamino)(3-pyridylamino)methylene)

Systematic Name

  • Urea, (((1,1-dimethylpropyl)amino)(3-pyridinylamino)methylene)-

Registry Numbers

CAS Registry Number

  • 67026-77-1

System Generated Number

  • 0067026771

Structure Descriptors

InChI

1S/C12H19N5O/c1-4-12(2,3)17-11(16-10(13)18)15-9-6-5-7-14-8-9/h5-8H,4H2,1-3H3,(H4,13,15,16,17,18)

InChIKey

WBISBEQTZUMOHQ-UHFFFAOYSA-N

Smiles

CCC(C)(C)N/C(=N\C(=O)N)/Nc1cccnc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 21, Pg. 773, 1978.