Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(CSC2=CC=NC=C2)NC(C)=C(C#N)C1C1=CC=CC=C1C(F)(F)F

InChIKey

InChIKey=SPKMPSMHSFMFSU-UHFFFAOYSA-N

Formula

C23H20F3N3O2S

Mass

459.49

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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 - Dihydropyridinecarboxylic acid derivative - Aryl thioether - Dihydropyridine - Alkylarylthioether - Hydropyridine - Pyridine - Heteroaromatic compound - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Carboxylic acid ester - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Thioether - Sulfenyl compound - Azacycle - Organoheterocyclic compound - Alkyl fluoride - Carbonyl group - Organic oxide - Amine - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Alkyl halide - Organic oxygen compound - Cyanide - 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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