Compound Identification
SMILES
CC(C)NC1=NC=CC(=N1)C1=C(N=C(N1)C1OCC(C)(CNC(=O)C2=CC=CC=C2)CO1)C1=CC=C(F)C=C1
InChIKey
InChIKey=SMDJJGSBFXPMQH-UHFFFAOYSA-N
Formula
C29H31FN6O3
Mass
530.604
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
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 Azacyclic compounds Oxacyclic compounds Acetals Organic oxides Organofluorides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
5-phenylimidazole - 4-phenylimidazole - Benzamide - Benzoic acid or derivatives - 2,4,5-trisubstituted-imidazole - Benzoyl - Trisubstituted imidazole - Aminopyrimidine - Fluorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Meta-dioxane - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Oxacycle - Carboxylic acid derivative - Acetal - Organofluoride - Organic oxide - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organohalogen compound - Organic nitrogen 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