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Substance Name: Guanidine, N-(2,3-diethylcyclohexyl)-N'-(2-methyl-4-quinolinyl)-N''-2-thiazolyl-, monohydrochloride
RN: 72042-01-4
InChIKey: CDDOYVGODCKINE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H31-N5-S.Cl-H

Molecular Weight

  • 458.0708
 
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Names and Synonyms

Synonym

  • Guanidine, 1-(2,3-dimethylcyclohexyl)-2-(2-methyll-4-quinolyl)-3-(2-thiazolyl)-, hydrochloride

Systematic Name

  • Guanidine, N-(2,3-diethylcyclohexyl)-N'-(2-methyl-4-quinolinyl)-N''-2-thiazolyl-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 72042-01-4

System Generated Number

  • 0072042014

Molecular Formulas

Molecular Formula

  • C24-H31-N5-S.Cl-H

Molecular Formula Fragments

  • C24-H31-N5-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C24H31N5S.ClH/c1-4-17-9-8-12-20(18(17)5-2)27-23(29-24-25-13-14-30-24)28-22-15-16(3)26-21-11-7-6-10-19(21)22;/h6-7,10-11,13-15,17-18,20H,4-5,8-9,12H2,1-3H3,(H2,25,26,27,28,29);1H

InChIKey

CDDOYVGODCKINE-UHFFFAOYSA-N

Smiles

CCC1CCCC(C1CC)N/C(=N/c2nccs2)/Nc3cc(nc4c3cccc4)C.Cl

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.