Structure Information
Structure

Compound Identification

SMILES

[Na+].O[C@H](CCN1C(=NC(=C1C1=CC=CS1)C1=CC=C(F)C=C1)C(F)(F)F)C[C@@H](O)CC([O-])=O

InChIKey

InChIKey=YJAQBCRYWJFIRO-CTHHTMFSSA-M

Formula

C21H19F4N2NaO4S

Mass

494.44

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Imidazoles

Intermediate Tree Nodes

Substituted imidazoles

Direct Parent

Phenylimidazoles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

5-phenylimidazole - 4-phenylimidazole - 1,2,4,5-tetrasubstituted imidazole - Medium-chain hydroxy acid - Medium-chain fatty acid - Imidazolyl carboxylic acid derivative - Beta-hydroxy acid - Hydroxy fatty acid - Halobenzene - Fluorobenzene - Fatty acid - Aryl fluoride - Benzenoid - N-substituted imidazole - Fatty acyl - Hydroxy acid - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Thiophene - Carboxylic acid salt - Secondary alcohol - Organic metal halide - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carboxylic acid - Azacycle - Organic alkali metal salt - Organonitrogen compound - Organic sodium salt - Organic salt - Organic zwitterion - Alcohol - Organic nitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Organofluoride - Aromatic heteromonocyclic compound

Description

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

External Descriptors

Not available

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