Compound Identification
SMILES
CC1=NC2=C(C3=C(S2)C(=O)N(C(SCC(=O)C2=CC=C(Cl)C=C2)=N3)C2=CC=CC=C2)C(C)=C1
InChIKey
InChIKey=VRFJZUGOXDDEGK-UHFFFAOYSA-N
Formula
C25H18ClN3O2S2
Mass
492.01
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 Thienopyridines Aryl alkyl ketones Benzoyl derivatives Alkylarylthioethers Chlorobenzenes Methylpyridines Pyrimidones Aryl chlorides Heteroaromatic compounds Thiophenes Lactams Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Thienopyridine - Thienopyrimidine - Aryl thioether - Aryl alkyl ketone - Benzoyl - Pyrimidone - Halobenzene - Methylpyridine - Alkylarylthioether - Chlorobenzene - Benzenoid - Pyrimidine - Pyridine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Thiophene - Heteroaromatic compound - Lactam - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organosulfur 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