Compound Identification
SMILES
FC1=CC=C(C=C1)C(=O)CCCCCCCSC1=CN=C(CC2=CC(=O)N(CC3=CC=CC=C3)C=C2)NC1=O
InChIKey
InChIKey=IYRJVZBOPXEIAP-UHFFFAOYSA-N
Formula
C31H32FN3O3S
Mass
545.67
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
Butyrophenones Aryl alkyl ketones Benzoyl derivatives Pyrimidones Pyridinones Alkylarylthioethers Fluorobenzenes Dihydropyridines Aryl fluorides Hydropyrimidines Heteroaromatic compounds Lactams Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - Benzoyl - Aryl thioether - Aryl alkyl ketone - Dihydropyridine - Fluorobenzene - Halobenzene - Pyridinone - Pyrimidone - Alkylarylthioether - Benzenoid - Aryl fluoride - Aryl halide - Hydropyridine - Hydropyrimidine - Pyridine - Monocyclic benzene moiety - Pyrimidine - Heteroaromatic compound - Lactam - Organoheterocyclic compound - Azacycle - Thioether - Sulfenyl compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organosulfur compound - Organic nitrogen compound - Aromatic heteromonocyclic 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