Compound Identification
SMILES
CNC1=NC(=NC2=C1N=CN2C1=CC=C(C=C1)C(=O)OC)C(F)(F)F
InChIKey
InChIKey=CHKPOXQGJVKVLZ-UHFFFAOYSA-N
Formula
C15H12F3N5O2
Mass
351.289
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
-
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
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Imidazoles
Intermediate Tree Nodes
Substituted imidazoles
Direct Parent
Phenylimidazoles
Alternative Parents
6-alkylaminopurines Benzoic acid esters Benzoyl derivatives Aminopyrimidines and derivatives N-substituted imidazoles Imidolactams Methyl esters Heteroaromatic compounds Azacyclic compounds Organooxygen compounds Organofluorides Organic oxides Hydrocarbon derivatives Amines Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylimidazole - 6-alkylaminopurine - 6-aminopurine - Benzoate ester - Benzoic acid or derivatives - Imidazopyrimidine - Purine - Benzoyl - Aminopyrimidine - Benzenoid - Pyrimidine - Imidolactam - Monocyclic benzene moiety - N-substituted imidazole - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Alkyl fluoride - Organohalogen compound - Organofluoride - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Amine - Organic oxide - Alkyl halide - Aromatic heteropolycyclic 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