Compound Identification
SMILES
NC1=C(Br)C=C(C=C1Br)C(=O)CCC(=O)N1CCC(CC1)N1CC2=CC=CC=C2NC1=S
InChIKey
InChIKey=WFEMUGPSVUQEKJ-UHFFFAOYSA-N
Formula
C23H24Br2N4O2S
Mass
580.34
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
Butyrophenones Quinazolines N-acylpiperidines 2-bromoanilines Aryl alkyl ketones Benzoyl derivatives Pyrimidinethiones 2-Thiopyrimidines Bromobenzenes Aryl bromides Tertiary carboxylic acid amides Thioureas Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - Diazanaphthalene - Quinazoline - N-acyl-piperidine - Aniline or substituted anilines - Benzoyl - Aryl alkyl ketone - 2-bromoaniline - 2-thiopyrimidine - Thiopyrimidine - Halobenzene - Bromobenzene - Pyrimidinethione - Aryl bromide - Aryl halide - Piperidine - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Tertiary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Thiourea - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organonitrogen compound - Organosulfur compound - Primary amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organobromide - Organohalogen 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