Compound Identification
SMILES
CN1CCN(CC1)C(=O)C1(C)COC(OC1)C1=NC(=C(N1)C1=NC(NCCN)=NC=C1)C1=CC=C(F)C=C1
InChIKey
InChIKey=AWRVIIOPDVEWCO-UHFFFAOYSA-N
Formula
C26H33FN8O3
Mass
524.601
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 Secondary alkylarylamines N-methylpiperazines Aminopyrimidines and derivatives Fluorobenzenes 1,3-dioxanes Aryl fluorides Tertiary carboxylic acid amides Heteroaromatic compounds Trialkylamines Amino acids and derivatives Oxacyclic compounds Acetals Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Organofluorides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
5-phenylimidazole - 4-phenylimidazole - 2,4,5-trisubstituted-imidazole - Trisubstituted imidazole - Aminopyrimidine - Fluorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - N-methylpiperazine - N-alkylpiperazine - 1,4-diazinane - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Meta-dioxane - Benzenoid - Piperazine - Pyrimidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Carboxamide group - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Carboxylic acid derivative - Azacycle - Acetal - Oxacycle - Hydrocarbon derivative - Organic nitrogen compound - Primary aliphatic amine - Organohalogen compound - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - Primary amine - Amine - Organic oxide - 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