Compound Identification
SMILES
CCOC1=CC=C(C=C1)N1C(=O)C2=C(N=C1SCC(=O)C1=CC=C(Cl)C=C1)C1=CC=CC=C1N2
InChIKey
InChIKey=XVTZJAQTMFFRCX-UHFFFAOYSA-N
Formula
C26H20ClN3O3S
Mass
489.97
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
Indoles Pyrrolopyrimidines Aryl alkyl ketones Benzoyl derivatives Phenol ethers Phenoxy compounds Chlorobenzenes Alkylarylthioethers Alkyl aryl ethers Pyrimidones Aryl chlorides Heteroaromatic compounds Pyrroles Lactams Sulfenyl compounds Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Indole - Indole or derivatives - Pyrrolopyrimidine - Benzoyl - Phenoxy compound - Aryl thioether - Phenol ether - Aryl alkyl ketone - Alkyl aryl ether - Chlorobenzene - Halobenzene - Pyrimidone - Alkylarylthioether - Aryl halide - Pyrimidine - Monocyclic benzene moiety - Benzenoid - Aryl chloride - Pyrrole - Heteroaromatic compound - Lactam - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Ether - Organosulfur compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic 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