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Substance Name: 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(2-((difluoromethyl)thio)phenyl)-2,6-dimethyl-, dimethyl ester
RN: 87240-31-1
InChIKey: SXDFGSZLXVWKIJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H19-F2-N-O4-S

Molecular Weight

  • 383.4131
 
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Names and Synonyms

Synonyms

  • 2,6-Dimethyl-3,5-dicarbomethoxy-4-(o-difluoromethylthiophenyl)-1,4-dihydropyridine
  • 2,6-Dimethyl-3,5-dicarbomethoxy-4-(o-difluoromethylthiophenyl)-1,4-dihydropyridine [French]
  • 2,6-Dimethyl-3,5-dimethoxycarbonyl-4-(o-difluoromethylthiophenyl)-1,4-dihydropyridine
  • BRN 4271947

Systematic Name

  • 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(2-((difluoromethyl)thio)phenyl)-2,6-dimethyl-, dimethyl ester

Registry Numbers

CAS Registry Number

  • 87240-31-1

System Generated Number

  • 0087240311

Structure Descriptors

InChI

1S/C18H19F2NO4S/c1-9-13(16(22)24-3)15(14(10(2)21-9)17(23)25-4)11-7-5-6-8-12(11)26-18(19)20/h5-8,15,18,21H,1-4H3

InChIKey

SXDFGSZLXVWKIJ-UHFFFAOYSA-N

Smiles

CC1=C(C(C(=C(N1)C)C(=O)OC)c2ccccc2SC(F)F)C(=O)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 93mg/kg (93mg/kg)   Pharmaceutical Chemistry Journal Vol. 21, Pg. 327, 1987.