Structure Information
Structure

Compound Identification

SMILES

COC1=CC(C#N)=C(C2=NC3=C(N2)C2=C(NC4=C3C=CC=N4)C=NC=C2)C(=C1)C#N

InChIKey

InChIKey=WZCYDSXMBDCHBR-UHFFFAOYSA-N

Formula

C22H13N7O

Mass

391.394

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Imidazoles

Intermediate Tree Nodes

Substituted imidazoles

Direct Parent

Phenylimidazoles

Alternative Parents

Phenoxy compounds Methoxybenzenes Benzonitriles Anisoles Azepines Alkyl aryl ethers Pyridines and derivatives Imidolactams Heteroaromatic compounds Secondary amines Nitriles Azacyclic compounds Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-phenylimidazole - Anisole - Benzonitrile - Phenol ether - Methoxybenzene - Phenoxy compound - Azepine - Alkyl aryl ether - Imidolactam - Benzenoid - Monocyclic benzene moiety - Pyridine - Heteroaromatic compound - Azacycle - Secondary amine - Ether - Carbonitrile - Nitrile - Cyanide - Amine - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylimidazoles. These are polycyclic aromatic compounds containing a benzene ring linked to an imidazole ring through a CC or CN bond.

External Descriptors

Not available

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