Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC=C1C1=CC(=NC(=N1)S(=O)(=O)CCCC(=O)NC1=C(OC)C=CC(Cl)=C1)C(F)(F)F

InChIKey

InChIKey=CIEVANFRCDMGGA-UHFFFAOYSA-N

Formula

C23H21ClF3N3O5S

Mass

543.94

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazines

Subclass

Pyrimidines and pyrimidine derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrimidines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

4-phenylpyrimidine - Methoxyaniline - Anilide - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - N-arylamide - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aryl chloride - Fatty amide - Aryl halide - Benzenoid - Fatty acyl - Monocyclic benzene moiety - Sulfonyl - Heteroaromatic compound - Sulfone - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Ether - Organonitrogen compound - Organosulfur compound - Organooxygen compound - Alkyl fluoride - Organohalogen compound - Organic nitrogen compound - Carbonyl group - Organochloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alkyl halide - Organofluoride - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrimidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrimidine ring through a CC or CN bond. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.

External Descriptors

Not available

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