Compound Identification
SMILES
Cl.Cl.CSC1=CC=C(C=C1)C(=O)CCN1CCN(CC2=CC=CC=C2)CC1
InChIKey
InChIKey=QGTPAPQIKPTCRM-UHFFFAOYSA-N
Formula
C21H28Cl2N2OS
Mass
427.43
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
Thiophenol ethers Phenylmethylamines Benzylamines Benzoyl derivatives Aryl alkyl ketones N-alkylpiperazines Aralkylamines Alkylarylthioethers Beta-amino ketones Trialkylamines Sulfenyl compounds Azacyclic compounds Organic oxides Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Benzoyl - Aryl thioether - Benzylamine - Phenylmethylamine - Thiophenol ether - Aryl alkyl ketone - N-alkylpiperazine - Alkylarylthioether - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Piperazine - Beta-aminoketone - 1,4-diazinane - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Sulfenyl compound - Azacycle - Thioether - Hydrochloride - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Amine - 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