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Substance Name: 3-Pyridinecarboxamide, N-(2-((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)thio)hexyl)-
RN: 88222-15-5
InChIKey: HEQKLTKUUGQFBV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H38-N2-O2-S

Molecular Weight

  • 442.6642
 
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Names and Synonyms

Synonyms

  • 1-Nicotinoil-2-(3,5-di-t-butil-4-idrossifeniltio)esilammina
  • 1-Nicotinoil-2-(3,5-di-t-butil-4-idrossifeniltio)esilammina [Italian]
  • N-(2-((3,5-Bis(1,1-dimethylethyl)-4-hydroxyphenyl)thio)hexyl)-3-pyridinecarboxamide

Systematic Name

  • 3-Pyridinecarboxamide, N-(2-((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)thio)hexyl)-

Registry Numbers

CAS Registry Number

  • 88222-15-5

System Generated Number

  • 0088222155

Structure Descriptors

InChI

1S/C26H38N2O2S/c1-8-9-12-19(17-28-24(30)18-11-10-13-27-16-18)31-20-14-21(25(2,3)4)23(29)22(15-20)26(5,6)7/h10-11,13-16,19,29H,8-9,12,17H2,1-7H3,(H,28,30)

InChIKey

HEQKLTKUUGQFBV-UHFFFAOYSA-N

Smiles

CCCCC(CNC(=O)c1cccnc1)Sc2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Farmaco, Edizione Scientifica. Vol. 38, Pg. 664, 1983.