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Substance Name: 3-Pyridinecarboxylic acid, 1,4-dihydro-4-(2-(difluoromethoxy)phenyl)-2,6-dimethyl-5-((phenylamino)carbonyl)-, ethyl ester
RN: 110544-73-5
InChIKey: XWSCGCLAXSCUKR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H24-F2-N2-O4

Molecular Weight

  • 442.4596
 
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Names and Synonyms

Synonym

  • BRN 5656457

Systematic Name

  • 3-Pyridinecarboxylic acid, 1,4-dihydro-4-(2-(difluoromethoxy)phenyl)-2,6-dimethyl-5-((phenylamino)carbonyl)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 110544-73-5

System Generated Number

  • 0110544735

Structure Descriptors

InChI

1S/C24H24F2N2O4/c1-4-31-23(30)20-15(3)27-14(2)19(22(29)28-16-10-6-5-7-11-16)21(20)17-12-8-9-13-18(17)32-24(25)26/h5-13,21,24,27H,4H2,1-3H3,(H,28,29)

InChIKey

XWSCGCLAXSCUKR-UHFFFAOYSA-N

Smiles

CCOC(=O)C1=C(NC(=C(C1c2ccccc2OC(F)F)C(=O)Nc3ccccc3)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   Pharmaceutical Chemistry Journal Vol. 21, Pg. 327, 1987.