Compound Identification
SMILES
CC1=NC2=C(N1)C(=CC(N)=N2)C1CC2=C(N1)C=CC(CN1CCC(CC1)C(=O)C1=CC=C(F)C=C1)=C2
InChIKey
InChIKey=WJGXARGMQRDTJI-UHFFFAOYSA-N
Formula
C28H29FN6O
Mass
484.579
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 Alkyl-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
Alkyl-phenylketones
Alternative Parents
Indolines Imidazopyridines Aryl alkyl ketones Benzoyl derivatives Aminopyridines and derivatives Secondary alkylarylamines Aralkylamines Fluorobenzenes Piperidines Aryl fluorides Imidolactams Gamma-amino ketones Imidazoles Heteroaromatic compounds Trialkylamines Azacyclic compounds Organic oxides Organofluorides Hydrocarbon derivatives Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Imidazopyridine - Indole or derivatives - Dihydroindole - Benzoyl - Aryl alkyl ketone - Aminopyridine - Fluorobenzene - Halobenzene - Aralkylamine - Secondary aliphatic/aromatic amine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Gamma-aminoketone - Imidolactam - Piperidine - Pyridine - Benzenoid - Imidazole - Heteroaromatic compound - Azole - Tertiary aliphatic amine - Tertiary amine - Secondary amine - Organoheterocyclic compound - Azacycle - Organofluoride - Hydrocarbon derivative - Organonitrogen compound - Amine - Primary amine - Organic oxide - Organic nitrogen compound - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available