Structure Information
Structure

Compound Identification

SMILES

CC1=CC2=C(S1)C(C1=C(Cl)C(F)=C(Br)C=C1)=C([C@H](OC(C)(C)C)C(O)=O)C(C)=N2

InChIKey

InChIKey=KHBJVMCFWNBFSZ-SFHVURJKSA-N

Formula

C21H20BrClFNO3S

Mass

500.81

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyridines and derivatives

Subclass

Phenylpyridines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyridines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

4-phenylpyridine - Thienopyridine - 2,3,5-trisubstituted thiophene - Methylpyridine - Bromobenzene - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Thiophene - Azacycle - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Organic oxide - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organofluoride - Organochloride - Organohalogen compound - Organobromide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine ring through a CC or CN bond.

External Descriptors

Not available

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