Structure Information
Structure

Compound Identification

SMILES

COC1=C(CC2=NC(N)=NC(NC3=CC=C(C=C3)C#N)=N2)C=C(C=C1)C(C)=O

InChIKey

InChIKey=QZPBCAYTGXYGCU-UHFFFAOYSA-N

Formula

C20H18N6O2

Mass

374.404

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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 - Acetophenone - Phenol ether - Benzoyl - Benzonitrile - Aryl alkyl ketone - Aniline or substituted anilines - Methoxybenzene - Anisole - Phenoxy compound - 2,4-diamine-s-triazine - Aminotriazine - Amino-1,3,5-triazine - Alkyl aryl ether - Triazine - Monocyclic benzene moiety - Benzenoid - 1,3,5-triazine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Secondary amine - Ether - Carbonitrile - Nitrile - Organopnictogen compound - Amine - Primary amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - 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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