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Substance Name: Acetanilide, 4'-(4-isopropyl-3-oxo-1,2,3,4-tetrahydro-1-isoquinolyl)-2-(propylamino)-
RN: 54087-41-1
InChIKey: PWVTZSFIYJSYCX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H29-N3-O2

Molecular Weight

  • 379.501
 
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Names and Synonyms

Synonyms

  • 4'-(4-Isopropyl-3-oxo-1,2,3,4-tetrahydroisoquinolyl)-2-propylaminoacetanilide
  • Acetamide, N-(4-(4-isopropyl-3-oxo-1,2,3,4-tetrahydroisoquinolyl)phenyl)-2-propylamino-
  • BRN 0499471
  • N-(4-(4-Isopropyl-3-oxo-1,2,3,4-tetrahydroisoquinolyl)phenyl)-2-propylaminoacetamide

Systematic Name

  • Acetanilide, 4'-(4-isopropyl-3-oxo-1,2,3,4-tetrahydro-1-isoquinolyl)-2-(propylamino)-

Registry Numbers

CAS Registry Number

  • 54087-41-1

System Generated Number

  • 0054087411

Structure Descriptors

InChI

1S/C23H29N3O2/c1-14(2)21-18-7-5-6-8-19(18)22(26-23(21)28)16-9-11-17(12-10-16)25-20(27)13-24-15(3)4/h5-12,14-15,21-22,24H,13H2,1-4H3,(H,25,27)(H,26,28)

InChIKey

PWVTZSFIYJSYCX-UHFFFAOYSA-N

Smiles

c12[C@@H](c3ccc(NC(CNC(C)C)=O)cc3)NC(=O)[C@@H](c1cccc2)C(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 600mg/kg (600mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 1384, 1977.