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Substance Name: Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-4-(2-((difluoromethyl)sulfonyl)phenyl)-2-methyl-5-oxo-, ethyl ester
RN: 172982-79-5
InChIKey: OMZZBZOUUVPTCR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H17-F2-N-O6-S

Molecular Weight

  • 413.3953
 
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Names and Synonyms

  • Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-4-(2-((difluoromethyl)sulfonyl)phenyl)-2-methyl-5-oxo-, ethyl ester

Registry Numbers

CAS Registry Number

  • 172982-79-5

System Generated Number

  • 0172982795

Structure Descriptors

InChI

1S/C18H17F2NO6S/c1-3-26-16(22)13-9(2)21-11-8-27-17(23)15(11)14(13)10-6-4-5-7-12(10)28(24,25)18(19)20/h4-7,14,18,21H,3,8H2,1-2H3

InChIKey

OMZZBZOUUVPTCR-UHFFFAOYSA-N

Smiles

CCOC(=O)C1=C(NC2=C(C1c3ccccc3S(=O)(=O)C(F)F)C(=O)OC2)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 1gm/kg (1000mg/kg)   Pharmaceutical Chemistry Journal Vol. 29, Pg. 330, 1995.