Compound Identification
SMILES
CC1(COC(OC1)C1=NC(=C(N1)C1=NC(NCC2=CN=CC=C2)=NC=C1)C1=CC=C(F)C=C1)C(=O)N1CCOCC1
InChIKey
InChIKey=HCFAOKGKJFLVML-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
2,4,5-trisubstituted imidazoles Secondary alkylarylamines Aminopyrimidines and derivatives Fluorobenzenes 1,3-dioxanes Pyridines and derivatives Aryl fluorides Morpholines Tertiary carboxylic acid amides Heteroaromatic compounds Dialkyl ethers Azacyclic compounds Acetals Oxacyclic compounds Organic oxides Carbonyl compounds Organofluorides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
5-phenylimidazole - 4-phenylimidazole - 2,4,5-trisubstituted-imidazole - Trisubstituted imidazole - Fluorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aminopyrimidine - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Pyridine - Morpholine - Meta-dioxane - Oxazinane - Aryl fluoride - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Acetal - Oxacycle - Carboxylic acid derivative - Azacycle - Ether - Dialkyl ether - Organofluoride - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organohalogen 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