Compound Identification
SMILES
CN1CCN(CC1)C1=CC=C(NC2=NC=C(C(=O)C3=CC(F)=CC=C3)C(N)=N2)C=C1
InChIKey
InChIKey=OMWMSGVGDWMHKW-UHFFFAOYSA-N
Formula
C22H23FN6O
Mass
406.465
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Aryl-phenylketones
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Level 7
Phenylketones
-
Level 6
Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Aryl ketones - Phenylketones
Direct Parent
Aryl-phenylketones
Alternative Parents
Phenylpiperazines N-arylpiperazines Pyrimidinecarboxylic acids and derivatives Aniline and substituted anilines Benzoyl derivatives Dialkylarylamines Aminopyrimidines and derivatives Fluorobenzenes N-methylpiperazines Aryl fluorides Imidolactams Heteroaromatic compounds Vinylogous amides Trialkylamines Azacyclic compounds Organic oxides Organofluorides Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - Phenylpiperazine - N-arylpiperazine - Pyrimidine-5-carboxylic acid or derivatives - Benzoyl - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Aminopyrimidine - Fluorobenzene - Halobenzene - N-methylpiperazine - N-alkylpiperazine - Aryl halide - Aryl fluoride - Pyrimidine - Piperazine - Imidolactam - Benzenoid - Monocyclic benzene moiety - 1,4-diazinane - Heteroaromatic compound - Vinylogous amide - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organic oxide - Primary amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.
External Descriptors
Not available