Structure Information
Structure

Compound Identification

SMILES

CN1CCC(CC1)N1C=NC(=C1C1=NC(NC2CC(C)(C)NC(C)(C)C2)=NC=C1)C1=CC=C(F)C=C1

InChIKey

InChIKey=PTUBBUIEPTVTTD-UHFFFAOYSA-N

Formula

C28H38FN7

Mass

491.659

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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

Fluorobenzenes Aminopyrimidines and derivatives Piperidines N-substituted imidazoles Aryl fluorides Heteroaromatic compounds Trialkylamines Dialkylamines Azacyclic compounds Organofluorides Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

4-phenylimidazole - 5-phenylimidazole - Aminopyrimidine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Pyrimidine - Piperidine - N-substituted imidazole - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Azacycle - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteromonocyclic 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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