Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=C(C=C1)N1C(COC2=CC=CC3=C2N=CC=C3)=NN=C1SCC(=O)C1=CC=CC=C1

InChIKey

InChIKey=MXKKOAJAKBWXIY-UHFFFAOYSA-N

Formula

C26H19ClN4O2S

Mass

486.97

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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 - Aryl ketones - Phenylketones

Direct Parent

Alkyl-phenylketones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alkyl-phenylketone - Phenyltriazole - Phenyl-1,2,4-triazole - Quinoline - Aryl thioether - Benzoyl - Phenol ether - Aryl alkyl ketone - Chlorobenzene - Alkyl aryl ether - Halobenzene - Alkylarylthioether - Aryl halide - Pyridine - Benzenoid - Monocyclic benzene moiety - Aryl chloride - Triazole - 1,2,4-triazole - Azole - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Ether - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organosulfur compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.

External Descriptors

Not available

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