Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC(=C1)C(=O)CN1C=NC2=C(N(CC=C(Cl)Cl)C(N3CCC[C@H](N)C3)=C2C#N)C1=O

InChIKey

InChIKey=OLJQBDUKCIOPSC-INIZCTEOSA-N

Formula

C24H24Cl2N6O3

Mass

515.4

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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 - Pyrrolopyrimidine - Phenoxy compound - Anisole - Benzoyl - Methoxybenzene - Aryl alkyl ketone - Phenol ether - Dialkylarylamine - Alkyl aryl ether - 3-aminopiperidine - Pyrimidone - Monocyclic benzene moiety - Substituted pyrrole - Pyrimidine - Piperidine - Benzenoid - Heteroaromatic compound - Pyrrole - Tertiary amine - Ketene acetal or derivatives - Lactam - Azacycle - Ether - Chloroalkene - Haloalkene - Carbonitrile - Nitrile - Organoheterocyclic compound - Vinyl halide - Vinyl chloride - Primary aliphatic amine - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organic nitrogen compound - Amine - Primary amine - Cyanide - 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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