Compound Identification
SMILES
CC1(CNC(=O)C2=CC=CC=C2)COC(OC1)C1=NC(=C(N1)C1=NC(NCCC(N)=O)=NC=C1)C1=CC=C(F)C=C1
InChIKey
InChIKey=PVOAXLTWRILOHS-UHFFFAOYSA-N
Formula
C29H30FN7O4
Mass
559.602
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
Beta amino acids and derivatives 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 Primary carboxylic acid amides Oxacyclic compounds Acetals Azacyclic compounds Organic oxides Organofluorides Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - 5-phenylimidazole - 4-phenylimidazole - Benzamide - Benzoic acid or derivatives - 2,4,5-trisubstituted-imidazole - Benzoyl - Trisubstituted imidazole - Fluorobenzene - Halobenzene - Aminopyrimidine - Secondary aliphatic/aromatic amine - Meta-dioxane - Monocyclic benzene moiety - Benzenoid - Aryl halide - Aryl fluoride - Pyrimidine - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Primary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Oxacycle - Acetal - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - 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