Compound Identification
SMILES
COC1=CC=C(NC(=O)N2CCCC(C2)NC2=NC=CC(=N2)C2=C(N=C3OC=CN23)C2=CC=C(F)C=C2)C=C1
InChIKey
InChIKey=KHRPATOONHBWBT-UHFFFAOYSA-N
Formula
C28H26FN7O3
Mass
527.56
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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Subclass
Imidazoles
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Level 5
Substituted imidazoles
- Level 6 Phenylimidazoles
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Level 5
Substituted imidazoles
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Subclass
Imidazoles
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Class
Azoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Imidazoles
Intermediate Tree Nodes
Substituted imidazoles
Direct Parent
Phenylimidazoles
Alternative Parents
N-phenylureas Methoxyanilines Piperidinecarboxamides Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Aminopiperidines Aminopyrimidines and derivatives Fluorobenzenes Secondary alkylarylamines N-substituted imidazoles Aryl fluorides Oxazoles Heteroaromatic compounds Tertiary amines Ureas Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
5-phenylimidazole - 4-phenylimidazole - N-phenylurea - Methoxyaniline - 1-piperidinecarboxamide - Piperidinecarboxamide - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - 3-aminopiperidine - Aminopyrimidine - Fluorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Pyrimidine - Piperidine - Oxazole - Heteroaromatic compound - Tertiary amine - Urea - Secondary amine - Ether - Oxacycle - Azacycle - Carbonyl group - Organic oxygen compound - Amine - Organofluoride - Hydrocarbon derivative - Organonitrogen compound - Organohalogen compound - Organic nitrogen compound - Organooxygen compound - Organic oxide - 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