Structure Information
Structure

Compound Identification

SMILES

OCC1CN(CCO1)C1=NC(NC2=CC(Cl)=C(C=C2)C(F)(F)F)=C2N=C(NC3=C(Cl)C=CC=C3Cl)SC2=N1

InChIKey

InChIKey=KQCVWHLQEURCEO-UHFFFAOYSA-N

Formula

C23H18Cl3F3N6O2S

Mass

605.84

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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 - 1,3-thiazolo[5,4-d]pyrimidine - 1,3-dichlorobenzene - Dialkylarylamine - Aniline or substituted anilines - Aminopyrimidine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Morpholine - Oxazinane - Pyrimidine - Imidolactam - 1,3-thiazol-2-amine - Heteroaromatic compound - Thiazole - Azole - Tertiary amine - Secondary amine - Organoheterocyclic compound - Oxacycle - Dialkyl ether - Ether - Azacycle - Alkyl halide - Organic nitrogen compound - Hydrocarbon derivative - Alkyl fluoride - Amine - Organic oxygen compound - Primary alcohol - Alcohol - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - 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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