Structure Information
Structure

Compound Identification

SMILES

CC1=C(C#N)C2=NC3=CC=CC=C3N2C(=O)\C1=C\NNC1=CC=CC(=C1)C(F)(F)F

InChIKey

InChIKey=PQZYZZFAKNYFSM-LFIBNONCSA-N

Formula

C21H14F3N5O

Mass

409.372

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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 heteropolycyclic compounds

Substituents

Trifluoromethylbenzene - Benzimidazole - Imidazo[1,2-a]pyridine - Phenylhydrazine - Methylpyridine - Pyridinone - N-substituted imidazole - Pyridine - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Lactam - Azacycle - Organoheterocyclic compound - Carbonitrile - Nitrile - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Alkyl fluoride - Cyanide - Hydrazine derivative - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteropolycyclic 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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