Compound Identification
SMILES
CSC1=CC=CC(=C1)C(=O)CN1C(=O)N(C)C2=C(N(CC=C(C)C)C(=N2)N2CCCC(N)C2)C1=O
InChIKey
InChIKey=NZSQEXUGFPDXQT-UHFFFAOYSA-N
Formula
C25H32N6O3S
Mass
496.63
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
Xanthines 6-oxopurines Alkaloids and derivatives Thiophenol ethers Aryl alkyl ketones Benzoyl derivatives Dialkylarylamines Alkylarylthioethers Aminopiperidines Pyrimidones Aminoimidazoles N-substituted imidazoles Heteroaromatic compounds Vinylogous amides Ureas Lactams Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Organic oxides Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Xanthine - 6-oxopurine - Purinone - Purine - Imidazopyrimidine - Alkaloid or derivatives - Aryl thioether - Thiophenol ether - Benzoyl - Aryl alkyl ketone - Dialkylarylamine - 3-aminopiperidine - Pyrimidone - Alkylarylthioether - Aminoimidazole - Benzenoid - Piperidine - N-substituted imidazole - Monocyclic benzene moiety - Pyrimidine - Heteroaromatic compound - Imidazole - Vinylogous amide - Azole - Urea - Lactam - Thioether - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Primary amine - Primary aliphatic amine - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organosulfur 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