Structure Information
Structure

Compound Identification

SMILES

COC1=CC(C(=O)CSC2=NN=C(O2)[C@@H](C)OC2=CC=CC=C2F)=C(OC)C=C1

InChIKey

InChIKey=XFVGIOZCAFQZNS-GFCCVEGCSA-N

Formula

C20H19FN2O5S

Mass

418.44

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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 - Dimethoxybenzene - P-dimethoxybenzene - Phenol ether - Benzoyl - Aryl alkyl ketone - Phenoxy compound - Methoxybenzene - Anisole - Aryl thioether - Halobenzene - Alkylarylthioether - Fluorobenzene - Alkyl aryl ether - Aryl halide - Aryl fluoride - Monocyclic benzene moiety - Benzenoid - 1,3,4-oxadiazole - Azole - Oxadiazole - Heteroaromatic compound - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Ether - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organosulfur compound - Organonitrogen compound - Organohalogen compound - Organofluoride - 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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