Structure Information
Structure

Compound Identification

SMILES

CC(=O)NC1=CC=C(NC(=O)CSC2=NC(C)=C(CC(=O)C3=CC=C(Br)C=C3)C(C)=C2C#N)C=C1

InChIKey

InChIKey=BTSFWILYAXYWSX-UHFFFAOYSA-N

Formula

C26H23BrN4O3S

Mass

551.46

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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 - Acetanilide - Anilide - N-acetylarylamine - Aryl thioether - Benzoyl - 3-pyridinecarbonitrile - Aryl alkyl ketone - N-arylamide - Methylpyridine - Halobenzene - Bromobenzene - Alkylarylthioether - Aryl halide - Monocyclic benzene moiety - Aryl bromide - Pyridine - Benzenoid - Heteroaromatic compound - Acetamide - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Carboxylic acid derivative - Thioether - Carbonitrile - Nitrile - Organic oxide - Cyanide - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organosulfur 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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