Compound Identification
SMILES
CC(=O)C1=CC(NC(=O)CC2=NN3C(=N2)N=C(C)C(Cl)=C3C)=CC=C1
InChIKey
InChIKey=YBANHEMFBIBURQ-UHFFFAOYSA-N
Formula
C17H16ClN5O2
Mass
357.8
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
Triazolopyrimidines Anilides Acetophenones N-arylamides Benzoyl derivatives Aryl alkyl ketones Halopyrimidines Aryl chlorides Triazoles Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Acetophenone - Anilide - Triazolopyrimidine - Aryl alkyl ketone - N-arylamide - Benzoyl - Halopyrimidine - Aryl chloride - Aryl halide - Pyrimidine - Monocyclic benzene moiety - Benzenoid - Triazole - 1,2,4-triazole - Azole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - 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