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Substance Name: Benzenamine, N-(6-((4,6-dimethyl-2-pyrimidinyl)thio)hexyl)-
RN: 90094-34-1
InChIKey: PXJXGJSPSWHDSF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H25-N3-S

Molecular Weight

  • 315.483
 
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Names and Synonyms

Synonyms

  • 2-((5-Anilinohexyl)thio)-4,6-dimethylpyrimidine
  • BRN 5567811
  • Pyrimidine, 2-((5-anilinohexyl)thio)-4,6-dimethyl-

Systematic Name

  • Benzenamine, N-(6-((4,6-dimethyl-2-pyrimidinyl)thio)hexyl)-

Registry Numbers

CAS Registry Number

  • 90094-34-1

System Generated Number

  • 0090094341

Structure Descriptors

InChI

1S/C18H25N3S/c1-15-14-16(2)21-18(20-15)22-13-9-4-3-8-12-19-17-10-6-5-7-11-17/h5-7,10-11,14,19H,3-4,8-9,12-13H2,1-2H3

InChIKey

PXJXGJSPSWHDSF-UHFFFAOYSA-N

Smiles

c1(nc(cc(n1)C)C)SCCCCCCNc1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2gm/kg (2000mg/kg)   Russian Pharmacology and Toxicology Vol. 47, Pg. 67, 1984.