Compound Identification
SMILES
COC1(CCN(CC#C)C1)C1=CC(SC2=CC=C(C=C2)C(C)=O)=CC=C1
InChIKey
InChIKey=CMOMBYFIXXGEIS-UHFFFAOYSA-N
Formula
C22H23NO2S
Mass
365.49
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 Phenylpyrrolidines Acetophenones Benzylethers Benzoyl derivatives Aryl alkyl ketones Thiophenol ethers Aralkylamines N-alkylpyrrolidines Pyrroles Trialkylamines Sulfenyl compounds Acetylides Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - 3-phenylpyrrolidine - Diarylthioether - Acetophenone - Benzylether - Aryl thioether - Thiophenol ether - Benzoyl - Aryl alkyl ketone - Aralkylamine - Monocyclic benzene moiety - N-alkylpyrrolidine - Benzenoid - Pyrrolidine - Pyrrole - Tertiary aliphatic amine - Tertiary amine - Acetylide - Dialkyl ether - Ether - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Organonitrogen compound - Organosulfur compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - 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