Structure Information
Structure

Compound Identification

SMILES

C[C@H](OC(=O)C[C@H]1SC2=CC=CC=C2NC1=O)C(=O)C1=CC=C(NC(C)=O)C=C1

InChIKey

InChIKey=VURNWDIRQSTOSJ-KPZWWZAWSA-N

Formula

C21H20N2O5S

Mass

412.46

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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 heteropolycyclic compounds

Substituents

Alkyl-phenylketone - Acetanilide - Benzothiazine - N-acetylarylamine - Phenylpropane - Anilide - Aryl thioether - Benzoyl - N-arylamide - Aryl alkyl ketone - Alkylarylthioether - Alpha-acyloxy ketone - Monocyclic benzene moiety - Benzenoid - Para-thiazine - Acetamide - Secondary carboxylic acid amide - Lactam - Carboxylic acid ester - Carboxamide group - Azacycle - Thioether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organic oxide - 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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