Structure Information
Structure

Compound Identification

SMILES

CC1=CC(C)=C(NC(=O)CC2=NN=C(SCC(=O)C3=CC=C(Br)C=C3)N2CC=C)C=C1

InChIKey

InChIKey=VJKUREDKTIEUKE-UHFFFAOYSA-N

Formula

C23H23BrN4O2S

Mass

499.43

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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 - Anilide - N-arylamide - Aryl alkyl ketone - Benzoyl - Xylene - M-xylene - Aryl thioether - Alkylarylthioether - Bromobenzene - Halobenzene - Monocyclic benzene moiety - Aryl bromide - Benzenoid - Aryl halide - Heteroaromatic compound - Azole - 1,2,4-triazole - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organosulfur compound - Organohalogen compound - Organobromide - Organonitrogen compound - 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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