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Substance Name: Guanidine, N-(1,1-dimethylethyl)-N'-1-isoquinolinyl-N''-2-thiazolyl-
RN: 72041-88-4
InChIKey: CYJJLEJTPWFUST-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H19-N5-S

Molecular Weight

  • 325.4381
 
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Names and Synonyms

Synonyms

  • BRN 5599139
  • Guanidine, 1-tert-butyl-2-(1-isoquinolinyl)-3-(2-thiazolyl)-
  • N-(1,1-Dimethylethyl)-N'-1-isoquinolinyl-N''-2-thiazolylguanidine

Systematic Name

  • Guanidine, N-(1,1-dimethylethyl)-N'-1-isoquinolinyl-N''-2-thiazolyl-

Registry Numbers

CAS Registry Number

  • 72041-88-4

System Generated Number

  • 0072041884

Structure Descriptors

InChI

1S/C17H19N5S/c1-17(2,3)22-15(21-16-19-10-11-23-16)20-14-13-7-5-4-6-12(13)8-9-18-14/h4-11H,1-3H3,(H2,18,19,20,21,22)

InChIKey

CYJJLEJTPWFUST-UHFFFAOYSA-N

Smiles

CC(C)(C)N/C(=N/c1nccs1)/Nc2c3ccccc3ccn2

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.