Structure Information
Structure

Compound Identification

SMILES

O[C@@]1(CC(NN=C2SC=C(N12)C1=CC=C(Cl)C=C1)=C1C=CC=CC1=O)C(F)(F)F

InChIKey

InChIKey=SKXPONVLENITHL-SFHVURJKSA-N

Formula

C19H13ClF3N3O2S

Mass

439.84

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones - Quinomethanes

Direct Parent

O-quinomethanes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

O-quinomethane - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Meta-thiazoline - Thiazole - Vinylogous amide - Fluorohydrin - Halohydrin - Azacycle - Organoheterocyclic compound - Alkanolamine - Hydrazone - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Organohalogen compound - Organochloride - Organofluoride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.

External Descriptors

Not available

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