Compound Identification
SMILES
COC1=C(C=CC(\C=C2/CC3(COC3)CN3C(CON=C23)C2=CC=C(F)C=C2)=C1)N1C=NC(C)=C1
InChIKey
InChIKey=CKBDWJDGRMFQIJ-ZVBGSRNCSA-N
Formula
C27H27FN4O3
Mass
474.536
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
Methoxyanilines Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Fluorobenzenes Piperidines N-substituted imidazoles Imidolactams Aryl fluorides Heteroaromatic compounds Tertiary amines Oxetanes Oxacyclic compounds Amidines Dialkyl ethers Azacyclic compounds Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylimidazole - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Halobenzene - Fluorobenzene - N-substituted imidazole - Aryl fluoride - Aryl halide - Imidolactam - Benzenoid - Piperidine - Monocyclic benzene moiety - Heteroaromatic compound - Tertiary amine - Oxetane - Amidine - Oxacycle - Azacycle - Dialkyl ether - Ether - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen 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