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Substance Name: Guanidine, N-cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)-
RN: 71079-27-1
InChIKey: YSLKPRIJGHRITG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H25-N5-S

Molecular Weight

  • 379.5295
 
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Names and Synonyms

Synonyms

  • BRN 5626782
  • Guanidine, 1-cyclohexyl-2-(2-methyl-4-quinolyl)-3-(3-methyl-5-isothiazolyl)-
  • N-Cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)guanidine

Systematic Name

  • Guanidine, N-cyclohexyl-N'-(3-methyl-5-isothiazolyl)-N''-(2-methyl-4-quinolinyl)-

Registry Numbers

CAS Registry Number

  • 71079-27-1

System Generated Number

  • 0071079271

Structure Descriptors

InChI

1S/C21H25N5S/c1-14-12-19(17-10-6-7-11-18(17)22-14)24-21(23-16-8-4-3-5-9-16)25-20-13-15(2)26-27-20/h6-7,10-13,16H,3-5,8-9H2,1-2H3,(H2,22,23,24,25)

InChIKey

YSLKPRIJGHRITG-UHFFFAOYSA-N

Smiles

Cc1cc(c2ccccc2n1)/N=C(\Nc3cc(ns3)C)/NC4CCCCC4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 23, Pg. 13, 1980.