Compound Identification
SMILES
CC(=O)C1=CC=C(C=C1)N1CCN(CC1)C(=O)CCC1N=C2N(C1=O)C(=S)NC1=CC=CC=C21
InChIKey
InChIKey=HDGOKIBEAAJPON-UHFFFAOYSA-N
Formula
C25H25N5O3S
Mass
475.57
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
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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
Phenylpiperazines N-arylpiperazines Quinazolines Alpha amino acids and derivatives Acetophenones Dialkylarylamines Aniline and substituted anilines Aryl alkyl ketones Benzoyl derivatives Pyrimidinethiones 2-Thiopyrimidines Imidazolinones Tertiary carboxylic acid amides Thioureas Propargyl-type 1,3-dipolar organic compounds Carboximidamides Azacyclic compounds Carboxamidines Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Phenylpiperazine - N-arylpiperazine - Alpha-amino acid or derivatives - Quinazoline - Acetophenone - Benzoyl - Tertiary aliphatic/aromatic amine - Aryl alkyl ketone - Dialkylarylamine - Aniline or substituted anilines - Thiopyrimidine - Pyrimidinethione - 2-thiopyrimidine - Monocyclic benzene moiety - 1,4-diazinane - Benzenoid - Imidazolinone - Piperazine - Pyrimidine - 2-imidazoline - Tertiary carboxylic acid amide - Thiourea - Carboxamide group - Tertiary amine - Amino acid or derivatives - Carboxylic acid amidine - Carboximidamide - Organoheterocyclic compound - Amidine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organosulfur compound - Amine - Organic oxide - 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