Structure Information
Structure

Compound Identification

SMILES

CCOC1=CC=C(C=C1)C(=O)[C@@H](C)SC1=NNC(=N1)C1=C(OC)C=CC(Cl)=C1

InChIKey

InChIKey=CCUYCNNFUXXJEH-GFCCVEGCSA-N

Formula

C20H20ClN3O3S

Mass

417.91

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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 heteromonocyclic compounds

Substituents

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