Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(COC[C@@H]2CCC3=NC(=C(N23)C2=NC(N)=NC=C2)C2=CC=C(F)C=C2)C=C1

InChIKey

InChIKey=BKLYUVKUMMLBIJ-IBGZPJMESA-N

Formula

C25H24FN5O2

Mass

445.498

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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

Benzylethers Phenoxy compounds Methoxybenzenes Anisoles Fluorobenzenes Aminopyrimidines and derivatives Alkyl aryl ethers N-substituted imidazoles Aryl fluorides Heteroaromatic compounds Dialkyl ethers Azacyclic compounds Primary amines Organofluorides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

5-phenylimidazole - 4-phenylimidazole - Benzylether - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Aminopyrimidine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Pyrimidine - Heteroaromatic compound - Azacycle - Ether - Dialkyl ether - Hydrocarbon derivative - Organic oxygen compound - Amine - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Primary amine - 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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