Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=C(C=C1)C(=O)CN1C(SC2=CC=CC=C2C1=O)=CC#N

InChIKey

InChIKey=RLKJIXWDIFRHRD-UHFFFAOYSA-N

Formula

C18H11ClN2O2S

Mass

354.81

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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 - Benzothiazine - Aryl thioether - Benzoyl - Aryl alkyl ketone - Chlorobenzene - Halobenzene - Meta-thiazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Vinylogous thioester - Benzenoid - Tertiary carboxylic acid amide - Carboxamide group - Ketene acetal or derivatives - Lactam - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Carbonitrile - Nitrile - Cyanide - Organochloride - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen 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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