Structure Information
Structure

Compound Identification

SMILES

COCCOC(CC(=O)C1=CC=C(C=C1)C1=CC=C(NC2=NC3=CC=CC=C3S2)C=C1)C(O)=O

InChIKey

InChIKey=ITMRIXWEQDPFQY-UHFFFAOYSA-N

Formula

C26H24N2O5S

Mass

476.55

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