Compound Identification
SMILES
CC1(COC(OC1)C1=NC(=C(N1)C1=NC(NCC(O)=O)=NC=C1)C1=CC=C(F)C=C1)C(=O)N1CCC(O)C1
InChIKey
InChIKey=NKTFIMJXZYYBRM-UHFFFAOYSA-N
Formula
C25H27FN6O6
Mass
526.525
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
Alpha amino acids and derivatives Imidazolyl carboxylic acids and derivatives 2,4,5-trisubstituted imidazoles N-acylpyrrolidines Aminopyrimidines and derivatives Secondary alkylarylamines Fluorobenzenes Aryl fluorides 1,3-dioxanes Heteroaromatic compounds Tertiary carboxylic acid amides Secondary alcohols Azacyclic compounds Oxacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Acetals Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
5-phenylimidazole - 4-phenylimidazole - Alpha-amino acid or derivatives - 2,4,5-trisubstituted-imidazole - N-acylpyrrolidine - Trisubstituted imidazole - Imidazolyl carboxylic acid derivative - Fluorobenzene - Aminopyrimidine - Secondary aliphatic/aromatic amine - Halobenzene - Aryl fluoride - Aryl halide - Pyrimidine - Monocyclic benzene moiety - Benzenoid - Meta-dioxane - Pyrrolidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Secondary alcohol - Carboxamide group - Monocarboxylic acid or derivatives - Azacycle - Oxacycle - Acetal - Carboxylic acid derivative - Carboxylic acid - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Alcohol - 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