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Substance Name: 5-Thiazolecarboxylic acid, 2-(((cyclohexylamino)((2-methyl-4-quinolinyl)amino)methylene)amino)-, ethyl ester
RN: 71079-23-7
InChIKey: JFTBBXZSHOTYAG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H27-N5-O2-S

Molecular Weight

  • 437.5653
 
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Names and Synonyms

Synonyms

  • 5-Thiazolecarboxylic acid, 2-(3-cyclohexyl-2-(2-methyl-4-quinolyl)guanidino)-, ethyl ester
  • BRN 5658013
  • Ethyl 2-((N-cyclohexyl-N'-(2-methylquinolyl)amidino)amino)-5-thiazolecarboxylate

Systematic Name

  • 5-Thiazolecarboxylic acid, 2-(((cyclohexylamino)((2-methyl-4-quinolinyl)amino)methylene)amino)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 71079-23-7

System Generated Number

  • 0071079237

Structure Descriptors

InChI

1S/C23H27N5O2S/c1-3-30-21(29)20-14-24-23(31-20)28-22(26-16-9-5-4-6-10-16)27-19-13-15(2)25-18-12-8-7-11-17(18)19/h7-8,11-14,16H,3-6,9-10H2,1-2H3,(H2,24,25,26,27,28)

InChIKey

JFTBBXZSHOTYAG-UHFFFAOYSA-N

Smiles

CCOC(=O)c1cnc(s1)/N=C(/Nc2cc(nc3c2cccc3)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.