Structure Information
Structure

Compound Identification

SMILES

CC1(C)CC2=C(CO1)SC1=C2C2=NC=NN2C2=NN=C(SCC(=O)C3=CC=CC=C3)N12

InChIKey

InChIKey=YQZTYYYKYSWVDA-UHFFFAOYSA-N

Formula

C21H18N6O2S2

Mass

450.54

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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 - Triazolopyrimidine - Thienopyrimidine - Thienopyran - Aryl alkyl ketone - Benzoyl - Aryl thioether - Alkylarylthioether - Pyran - Pyrimidine - Benzenoid - Monocyclic benzene moiety - Azole - Heteroaromatic compound - Triazole - 1,2,4-triazole - Thiophene - Dialkyl ether - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Thioether - Sulfenyl compound - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Aldehyde - 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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