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Substance Name: Guanidine, 1-tert-butyl-2-(2-isobutyl-4-quinolyl)-3-(2-thiazolyl)
RN: 71079-96-4
InChIKey: OEZLBYGFUZUHJL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H27-N5-S

Molecular Weight

  • 381.545
 
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Names and Synonyms

Synonyms

  • 1-tert-Butyl-2-(2-isobutyl-4-quinolyl)-3-(2-thiazolyl)guanidine
  • BRN 5619019

Systematic Name

  • Guanidine, 1-tert-butyl-2-(2-isobutyl-4-quinolyl)-3-(2-thiazolyl)

Registry Numbers

CAS Registry Number

  • 71079-96-4

System Generated Number

  • 0071079964

Structure Descriptors

InChI

1S/C21H27N5S/c1-14(2)12-15-13-18(16-8-6-7-9-17(16)23-15)24-19(26-21(3,4)5)25-20-22-10-11-27-20/h6-11,13-14H,12H2,1-5H3,(H2,22,23,24,25,26)

InChIKey

OEZLBYGFUZUHJL-UHFFFAOYSA-N

Smiles

c12c(\N=C(/Nc3nccs3)NC(C)(C)C)cc(CC(C)C)nc1cccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 600mg/kg (600mg/kg)   Journal of Medicinal Chemistry. Vol. 23, Pg. 13, 1980.