Structure Information
Structure

Compound Identification

SMILES

CC(=O)C1=CC=CC=C1C1=CC(NC2=NC=CC(=N2)C2=NC=CS2)=CC=C1

InChIKey

InChIKey=XCSDDASATNRQGH-UHFFFAOYSA-N

Formula

C21H16N4OS

Mass

372.45

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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 - Biphenyl - Acetophenone - Benzoyl - Aniline or substituted anilines - Aryl alkyl ketone - Aminopyrimidine - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Azacycle - Organoheterocyclic compound - Secondary amine - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - 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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