Structure Information
Structure

Compound Identification

SMILES

CCCCCCCCOC1=C(C=C(NC2=NC(=CS2)C2=CC3=C(COOC3)C=C2)C=C1)C(F)(F)F

InChIKey

InChIKey=NEOBKKJBFSDGEW-UHFFFAOYSA-N

Formula

C26H29F3N2O3S

Mass

506.58

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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

Benzo-2,3-dioxane - Benzodioxane - Trifluoromethylbenzene - Phenoxy compound - Phenol ether - Aniline or substituted anilines - Alkyl aryl ether - 2,4-disubstituted 1,3-thiazole - 1,3-thiazol-2-amine - Heteroaromatic compound - Thiazole - Azole - Dialkyl peroxide - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Amine - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - 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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