Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C(=O)CSC1=NC=C(N1C1=CC=CC=C1C)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=WUFRTIBNTPMXEE-UHFFFAOYSA-N
Formula
C26H23ClN2O3S
Mass
478.99
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
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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
Phenylimidazoles Dimethoxybenzenes 1,2,5-trisubstituted imidazoles Phenoxy compounds Anisoles Aryl alkyl ketones Benzoyl derivatives Toluenes Alkyl aryl ethers Alkylarylthioethers Chlorobenzenes N-substituted imidazoles Aryl chlorides Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - 5-phenylimidazole - 1-phenylimidazole - 4-phenylimidazole - Dimethoxybenzene - O-dimethoxybenzene - Benzoyl - Phenol ether - Phenoxy compound - Aryl thioether - Trisubstituted imidazole - Aryl alkyl ketone - 1,2,5-trisubstituted-imidazole - Methoxybenzene - Anisole - Toluene - Alkylarylthioether - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aryl halide - N-substituted imidazole - Benzenoid - Aryl chloride - Monocyclic benzene moiety - Azole - Imidazole - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Ether - Organic nitrogen compound - Organic oxide - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - Organochloride - Organohalogen 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