Compound Identification
SMILES
[Na+].[S-]\C(SCC(=O)C1=CC=CC=C1)=C(\C#N)C(=O)NC1=CC=CC=C1
InChIKey
InChIKey=ADKCPFDRRUTUSL-FLNCGGNMSA-M
Formula
C18H13N2NaO2S2
Mass
376.42
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
-
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
Anilides N-arylamides Benzoyl derivatives Aryl alkyl ketones Vinylogous thioesters Secondary carboxylic acid amides Ketene acetals Sulfenyl compounds Nitriles Organic zwitterions Organic sodium salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Anilide - Benzoyl - N-arylamide - Aryl alkyl ketone - Monocyclic benzene moiety - Vinylogous thioester - Benzenoid - Carboxamide group - Ketene acetal or derivatives - Secondary carboxylic acid amide - Carboxylic acid derivative - Carbonitrile - Nitrile - Organic alkali metal salt - Sulfenyl compound - Organosulfur compound - Organonitrogen compound - Cyanide - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic sodium salt - Organic zwitterion - Organic salt - Aromatic homomonocyclic 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