Structure Information
Structure

Compound Identification

SMILES

CC1(CNC(=O)C2=CC=CC=C2)COC(OC1)C1=NC(=C(N1)C1=NC(NCCC#N)=NC=C1)C1=CC=C(F)C=C1

InChIKey

InChIKey=CSBACBROVIBUAM-UHFFFAOYSA-N

Formula

C29H28FN7O3

Mass

541.587

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Imidazoles

Intermediate Tree Nodes

Substituted imidazoles

Direct Parent

Phenylimidazoles

Alternative Parents

Benzamides 2,4,5-trisubstituted imidazoles Benzoyl derivatives Secondary alkylarylamines Aminopyrimidines and derivatives Fluorobenzenes 1,3-dioxanes Aryl fluorides Heteroaromatic compounds Secondary carboxylic acid amides Nitriles Azacyclic compounds Acetals Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Organopnictogen compounds

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

5-phenylimidazole - 4-phenylimidazole - Benzamide - Benzoic acid or derivatives - 2,4,5-trisubstituted-imidazole - Benzoyl - Trisubstituted imidazole - Aminopyrimidine - Fluorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Meta-dioxane - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Oxacycle - Nitrile - Carbonitrile - Acetal - Carboxylic acid derivative - Organonitrogen compound - Organic oxide - Cyanide - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organohalogen compound - Organofluoride - Organic nitrogen 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

Previous Back Next