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Substance Name: Acetamide, 2-(bis(1-methylethyl)amino)-N-(5,11-dihydro(1)benzoxepino(3,4-b)pyridin-5-yl)-
RN: 95968-39-1
InChIKey: XOZRXMYTIZSTJV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H27-N3-O2

Molecular Weight

  • 353.4633
 
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Names and Synonyms

Synonyms

  • 2-(Bis(1-methylethyl)amino)-N-(5,11-dihydro(1)benzoxepino(3,4-b)pyridin-5-yl)acetamide
  • 5,11-Dihydro-5-((N,N-diisopropylamino)acetyl)amino(1)benzoxepino(3,4-b)pyridine

Systematic Name

  • Acetamide, 2-(bis(1-methylethyl)amino)-N-(5,11-dihydro(1)benzoxepino(3,4-b)pyridin-5-yl)-

Registry Numbers

CAS Registry Number

  • 95968-39-1

System Generated Number

  • 0095968391

Structure Descriptors

InChI

1S/C21H27N3O2/c1-14(2)24(15(3)4)12-20(25)23-21-16-9-7-11-22-18(16)13-26-19-10-6-5-8-17(19)21/h5-11,14-15,21H,12-13H2,1-4H3,(H,23,25)

InChIKey

XOZRXMYTIZSTJV-UHFFFAOYSA-N

Smiles

C1(c2c(nccc2)COc2c1cccc2)NC(=O)CN(C(C)C)C(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 100mg/kg (100mg/kg)   European Patent Application. Vol. #0129879,
mouse LD oral > 300mg/kg (300mg/kg)   European Patent Application. Vol. #0129879,