Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(N=C(C)N=C1C(C)C)C(=O)N1CCN(C(C)C1)C(=O)C1=CC=C(C=C1)C(F)(F)F

InChIKey

InChIKey=PPDKXPAUHDBUTB-UHFFFAOYSA-N

Formula

C24H27F3N4O4

Mass

492.499

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Trifluoromethylbenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Trifluoromethylbenzenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Trifluoromethylbenzene - Benzamide - Benzoic acid or derivatives - Pyrimidine-6-carboxylic acid or derivatives - Pyrimidine-5-carboxylic acid or derivatives - Pyrimidine-5-carboxylic acid - 2-heteroaryl carboxamide - Benzoyl - 1,4-diazinane - Pyrimidine - Piperazine - Heteroaromatic compound - Methyl ester - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organohalogen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.

External Descriptors

Not available

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