Compound Identification
SMILES
OC(=O)C(F)(F)F.NC1CCN(C1)C1=NC2=C(N=CN2C2=CC(F)=CC=C2)C(NCC2=NC3=C(N2)C=C(Cl)C=C3)=N1
InChIKey
InChIKey=XNYMXHPOKLCQQD-UHFFFAOYSA-N
Formula
C25H22ClF4N9O2
Mass
591.96
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Imidazoles
-
Level 5
Substituted imidazoles
- Level 6 Phenylimidazoles
-
Level 5
Substituted imidazoles
-
Subclass
Imidazoles
-
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 Benzimidazoles Dialkylarylamines Aminopyrimidines and derivatives Fluorobenzenes Aryl chlorides Aryl fluorides N-substituted imidazoles Imidolactams Heteroaromatic compounds Alpha-halocarboxylic acids Pyrrolidines Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Organochlorides Alkyl fluorides Hydrocarbon derivatives Organofluorides Monoalkylamines
Molecular Framework
Not available
Substituents
1-phenylimidazole - 6-alkylaminopurine - 6-aminopurine - Benzimidazole - Imidazopyrimidine - Purine - Dialkylarylamine - Aminopyrimidine - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Imidolactam - Benzenoid - Pyrimidine - Pyrrolidine - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Carboxylic acid - Organochloride - Hydrocarbon derivative - Primary aliphatic amine - Carbonyl group - Organic oxide - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Amine - Primary amine - Organic oxygen compound - 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