Structure Information
Structure

Compound Identification

SMILES

COC1=CC2=C(C=C1)N=C(NC1=CC=C(C=C1)C1=CC=C(C=C1)C(=O)CC(C)C(O)=O)S2

InChIKey

InChIKey=QSUOJEMDDNRUDJ-UHFFFAOYSA-N

Formula

C25H22N2O4S

Mass

446.52

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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 - Biphenyl - Butyrophenone - 1,3-benzothiazole - Anisole - Benzoyl - Gamma-keto acid - Phenol ether - Aryl alkyl ketone - Aniline or substituted anilines - Alkyl aryl ether - Benzenoid - 1,3-thiazol-2-amine - Monocyclic benzene moiety - Keto acid - Heteroaromatic compound - Thiazole - Azole - Amino acid or derivatives - Amino acid - Azacycle - Secondary amine - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Carboxylic acid - Organic nitrogen compound - Amine - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - 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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