Compound Identification
SMILES
CC(=O)C1=CC=C(C=C1)N1CCN(CC1)C(=S)NC1=CC=CC(C)=C1C
InChIKey
InChIKey=BWCVSFVHCQLLFK-UHFFFAOYSA-N
Formula
C21H25N3OS
Mass
367.51
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
Phenylpiperazines N-arylpiperazines N-phenylthioureas Acetophenones o-Xylenes Dialkylarylamines Benzoyl derivatives Aryl alkyl ketones Aniline and substituted anilines Thioureas Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Phenylpiperazine - N-arylpiperazine - N-phenylthiourea - Acetophenone - Benzoyl - O-xylene - Tertiary aliphatic/aromatic amine - Xylene - Aryl alkyl ketone - Dialkylarylamine - Aniline or substituted anilines - Monocyclic benzene moiety - Piperazine - Benzenoid - 1,4-diazinane - Thiourea - Tertiary amine - Organoheterocyclic compound - Azacycle - Amine - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - 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