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Substance Name: 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-2,3-bis(4-methylphenyl)-9-methyl-
RN: 124392-77-4
InChIKey: RRVYJERJHIYNTN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H24-N2-O

Molecular Weight

  • 380.4886
 
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Names and Synonyms

Synonyms

  • 4,5-Dihydro-2,3-bis(4-methylphenyl)-9-methyl-2H-(1)benzoxepino(5,4-c)pyrazole
  • BRN 4573686

Systematic Name

  • 2H-(1)Benzoxepino(5,4-c)pyrazole, 4,5-dihydro-2,3-bis(4-methylphenyl)-9-methyl-

Registry Numbers

CAS Registry Number

  • 124392-77-4

System Generated Number

  • 0124392774

Structure Descriptors

InChI

1S/C26H24N2O/c1-17-4-9-20(10-5-17)26-22-14-15-29-24-13-8-19(3)16-23(24)25(22)27-28(26)21-11-6-18(2)7-12-21/h4-13,16H,14-15H2,1-3H3

InChIKey

RRVYJERJHIYNTN-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)c2c3c(nn2c4ccc(cc4)C)-c5cc(ccc5OCC3)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 681mg/kg (681mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 28, Pg. 37, 1989.