Structure Information
Structure

Compound Identification

SMILES

CC1=CC(=NC=C1C(SCCCO)C1=C(F)C=CC(F)=C1F)C(O)=O

InChIKey

InChIKey=YLOPWVZEIUIAJE-UHFFFAOYSA-N

Formula

C17H16F3NO3S

Mass

371.37

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyridines and derivatives

Subclass

Pyridinecarboxylic acids and derivatives

Intermediate Tree Nodes

Pyridinecarboxylic acids - Pyridine-2-carboxylic acids

Direct Parent

5-alkyl-2-carboxypyrimidines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

5-alkyl-2-carboxypyrimidine - Methylpyridine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Carboxylic acid derivative - Carboxylic acid - Azacycle - Thioether - Sulfenyl compound - Dialkylthioether - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Primary alcohol - Organic oxygen compound - Organic oxide - Alcohol - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 5-alkyl-2-carboxypyrimidines. These are pyrimidine-2-carboxylic acids that carry an alkyl group at the 5-position of the pyridine ring.

External Descriptors

Not available

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