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Substance Name: Acetamide, 2-(ethylamino)-N-(4-(1,2,3,4-tetrahydro-4,4-dimethyl-3-oxo-1-isoquinolinyl)phenyl)-
RN: 54087-43-3
InChIKey: OBFDDLLWPWKRAH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H25-N3-O2

Molecular Weight

  • 351.448
 
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Names and Synonyms

Synonyms

  • 2-(Ethylamino)-N-(4-(1,2,3,4-tetrahydro-4,4-dimethyl-3-oxo-1-isoquinolinyl)phenyl)acetamide
  • BRN 0498021

Systematic Name

  • Acetamide, 2-(ethylamino)-N-(4-(1,2,3,4-tetrahydro-4,4-dimethyl-3-oxo-1-isoquinolinyl)phenyl)-

Registry Numbers

CAS Registry Number

  • 54087-43-3

System Generated Number

  • 0054087433

Structure Descriptors

InChI

1S/C21H25N3O2/c1-4-22-13-18(25)23-15-11-9-14(10-12-15)19-16-7-5-6-8-17(16)21(2,3)20(26)24-19/h5-12,19,22H,4,13H2,1-3H3,(H,23,25)(H,24,26)

InChIKey

OBFDDLLWPWKRAH-UHFFFAOYSA-N

Smiles

N1C(C(C)(C)c2c([C@@H]1c1ccc(NC(=O)CNCC)cc1)cccc2)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 2gm/kg (2000mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 1384, 1977.