Compound Identification
SMILES
Cl.CN1CCN(CC1)C(=O)C1=CC=CC=C1SC1=C(C=C(Cl)C=C1)C(C)=O
InChIKey
InChIKey=ZPBFHVORVGUEED-UHFFFAOYSA-N
Formula
C20H22Cl2N2O2S
Mass
425.37
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
Diarylthioethers O-sulfanylbenzoic acids and derivatives Acetophenones Benzamides Thiophenol ethers Aryl alkyl ketones Benzoyl derivatives N-methylpiperazines Chlorobenzenes Vinylogous thioesters Aryl chlorides Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Sulfenyl compounds Azacyclic compounds Hydrochlorides Organic oxides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Diarylthioether - O-sulfanylbenzoic acid or derivatives - Acetophenone - Benzamide - Benzoic acid or derivatives - Aryl thioether - Benzoyl - Aryl alkyl ketone - Thiophenol ether - Chlorobenzene - Halobenzene - N-alkylpiperazine - N-methylpiperazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Vinylogous thioester - 1,4-diazinane - Piperazine - Benzenoid - Tertiary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxamide group - Carboxylic acid derivative - Thioether - Azacycle - Sulfenyl compound - Organoheterocyclic compound - Hydrochloride - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Organosulfur compound - Organohalogen compound - Organochloride - Organonitrogen 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