Compound Identification
SMILES
OC(=O)C1COC(OC1)C1=NC(=C(N1)C1=NC(NCC2=CC=CC=N2)=NC=C1)C1=CC=C(F)C=C1
InChIKey
InChIKey=AFYOWCDAQCTIKS-UHFFFAOYSA-N
Formula
C24H21FN6O4
Mass
476.468
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
2,4,5-trisubstituted imidazoles 2-pyridylmethylamines Imidazolyl carboxylic acids and derivatives Secondary alkylarylamines Aminopyrimidines and derivatives Fluorobenzenes Aryl fluorides 1,3-dioxanes Heteroaromatic compounds Oxacyclic compounds Carboxylic acids Azacyclic compounds Acetals Monocarboxylic acids and derivatives Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
5-phenylimidazole - 4-phenylimidazole - 2-pyridylmethylamine - 2,4,5-trisubstituted-imidazole - Imidazolyl carboxylic acid derivative - Trisubstituted imidazole - Fluorobenzene - Halobenzene - Aminopyrimidine - Secondary aliphatic/aromatic amine - Meta-dioxane - Aryl fluoride - Monocyclic benzene moiety - Aryl halide - Pyridine - Pyrimidine - Benzenoid - Heteroaromatic compound - Monocarboxylic acid or derivatives - Oxacycle - Carboxylic acid - Carboxylic acid derivative - Azacycle - Acetal - Organic nitrogen compound - Organohalogen compound - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen 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