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Substance Name: 2,4-Hexadienamide, N-(2-((methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)-
RN: 141284-13-1
InChIKey: KGRLVMKLVFWFAW-VNKDHWASSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H14-F3-N3-O3-S

Molecular Weight

  • 349.3316
 
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Names and Synonyms

Synonym

  • N-(2-((Methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)-2,4-hexadienamide

Systematic Name

  • 2,4-Hexadienamide, N-(2-((methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)-

Registry Numbers

CAS Registry Number

  • 141284-13-1

System Generated Number

  • 0141284131

Structure Descriptors

InChI

1S/C13H14F3N3O3S/c1-3-4-5-6-11(20)18-10-7-9(13(14,15)16)8-17-12(10)19-23(2,21)22/h3-8H,1-2H3,(H,17,19)(H,18,20)/b4-3+,6-5+

InChIKey

KGRLVMKLVFWFAW-VNKDHWASSA-N

Smiles

C/C=C/C=C/C(=O)Nc1cc(cnc1NS(=O)(=O)C)C(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous > 80mg/kg (80mg/kg)   United States Patent Document. Vol. #5492908,