Compound Identification
SMILES
CC(C)C1CC2=C(CO1)SC1=NC(SCC(=O)C3=CC=C(F)C=C3)=NC(N)=C21
InChIKey
InChIKey=UIZKHPDISLZLNI-UHFFFAOYSA-N
Formula
C20H20FN3O2S2
Mass
417.52
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
Thienopyrimidines Thienopyrans Aryl alkyl ketones Benzoyl derivatives Alkylarylthioethers Aminopyrimidines and derivatives Fluorobenzenes Pyrans Aryl fluorides Primary aromatic amines Imidolactams Heteroaromatic compounds Thiophenes Oxacyclic compounds Dialkyl ethers Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Aldehydes Organic oxides Organofluorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Thienopyran - Thienopyrimidine - Aryl thioether - Benzoyl - Aryl alkyl ketone - Aminopyrimidine - Fluorobenzene - Halobenzene - Alkylarylthioether - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Primary aromatic amine - Pyran - Pyrimidine - Benzenoid - Imidolactam - Heteroaromatic compound - Thiophene - Organoheterocyclic compound - Azacycle - Sulfenyl compound - Thioether - Oxacycle - Dialkyl ether - Ether - Organopnictogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organosulfur compound - Primary amine - Organic nitrogen compound - Aldehyde - Amine - 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