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Substance Name: 5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-(2-(difluoromethoxy)phenyl)-1,6-dimethyl-2-oxo-, 1-methylethyl ester
RN: 111983-62-1
InChIKey: NSUYMLINQCECJQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H20-F2-N2-O4

Molecular Weight

  • 354.351
 
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Names and Synonyms

Synonym

  • BRN 5623638

Systematic Name

  • 5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-(2-(difluoromethoxy)phenyl)-1,6-dimethyl-2-oxo-, 1-methylethyl ester

Registry Numbers

CAS Registry Number

  • 111983-62-1

System Generated Number

  • 0111983621

Structure Descriptors

InChI

1S/C17H20F2N2O4/c1-9(2)24-15(22)13-10(3)21(4)17(23)20-14(13)11-7-5-6-8-12(11)25-16(18)19/h5-9,14,16H,1-4H3,(H,20,23)

InChIKey

NSUYMLINQCECJQ-UHFFFAOYSA-N

Smiles

CC1=C(C(NC(=O)N1C)c2ccccc2OC(F)F)C(=O)OC(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 100mg/kg (100mg/kg)   Pharmaceutical Chemistry Journal Vol. 21, Pg. 571, 1987.