Compound Identification
SMILES
CC1(COC(OC1)C1=NC(=C(N1)C1=NC(NCCC(O)=O)=NC=C1)C1=CC=C(F)C=C1)C(=O)NC1CCCCC1
InChIKey
InChIKey=FSXZQJCYUOMAGF-UHFFFAOYSA-N
Formula
C28H33FN6O5
Mass
552.607
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 2,4,5-trisubstituted imidazoles Imidazolyl carboxylic acids and derivatives Secondary alkylarylamines Aminopyrimidines and derivatives Fluorobenzenes 1,3-dioxanes Aryl fluorides Heteroaromatic compounds Secondary carboxylic acid amides Oxacyclic compounds Acetals Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organofluorides Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
5-phenylimidazole - 4-phenylimidazole - Beta amino acid or derivatives - 2,4,5-trisubstituted-imidazole - Imidazolyl carboxylic acid derivative - Trisubstituted imidazole - Fluorobenzene - Aminopyrimidine - Secondary aliphatic/aromatic amine - Halobenzene - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Aryl fluoride - Meta-dioxane - Aryl halide - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - 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 - 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