Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC(=C1)C(=O)CSC1=NC2=C(SC(=C2)C2=CC=C(Cl)C=C2)C(=O)N1N

InChIKey

InChIKey=MLLGPPSNVHNNMH-UHFFFAOYSA-N

Formula

C21H16ClN3O3S2

Mass

457.95

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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 - Thienopyrimidine - Anisole - Benzoyl - Phenol ether - 2,3,5-trisubstituted thiophene - Aryl alkyl ketone - Methoxybenzene - Phenoxy compound - Aryl thioether - Alkylarylthioether - Chlorobenzene - Alkyl aryl ether - Pyrimidone - Halobenzene - Aryl halide - Benzenoid - Aryl chloride - Pyrimidine - Monocyclic benzene moiety - Thiophene - Heteroaromatic compound - Lactam - Sulfenyl compound - Thioether - Azacycle - Organoheterocyclic compound - Ether - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organosulfur compound - Organonitrogen compound - Organohalogen compound - Organochloride - 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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