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Substance Name: Pentanediamide, N,N'-dibutyl-2-((3-(2-furanyl)-1-oxo-2-propenyl)amino)-, (+-)-
RN: 96784-98-4
InChIKey: UXRWRQAYXKNJEQ-PKNBQFBNSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H31-N3-O4

Molecular Weight

  • 377.482
 
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Names and Synonyms

Synonym

  • (+-)-N,N'-Dibutyl-2-((3-(2-furanyl)-1-oxo-2-propenyl)amino)pentanediamide

Systematic Name

  • Pentanediamide, N,N'-dibutyl-2-((3-(2-furanyl)-1-oxo-2-propenyl)amino)-, (+-)-

Registry Numbers

CAS Registry Number

  • 96784-98-4

System Generated Number

  • 0096784984

Structure Descriptors

InChI

1S/C20H31N3O4/c1-3-5-13-21-18(24)12-10-17(20(26)22-14-6-4-2)23-19(25)11-9-16-8-7-15-27-16/h7-9,11,15,17H,3-6,10,12-14H2,1-2H3,(H,21,24)(H,22,26)(H,23,25)/b11-9+

InChIKey

UXRWRQAYXKNJEQ-PKNBQFBNSA-N

Smiles

C([C@@H](CCC(=O)NCCCC)NC(\C=C\c1occc1)=O)(=O)NCCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 600mg/kg (600mg/kg)   United States Patent Document. Vol. #4610983,