Compound Identification
SMILES
CC(C)CC1=CC=C(CCC2=CC(C(=O)C3=CC=CC=C3Cl)=C(NC(=O)C(C)N)S2)C=C1
InChIKey
InChIKey=NKUWABBAFOFGSV-UHFFFAOYSA-N
Formula
C26H29ClN2O2S
Mass
469.04
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 Aryl-phenylketones
-
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
Aryl-phenylketones
Alternative Parents
3-aroylthiophenes Alpha amino acid amides Alanine and derivatives Phenylpropanes 2,3,5-trisubstituted thiophenes Thiophene carboxylic acids and derivatives Benzoyl derivatives N-arylamides Chlorobenzenes Aryl chlorides Heteroaromatic compounds Vinylogous halides Vinylogous amides Secondary carboxylic acid amides Monoalkylamines Organic oxides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - Alpha-amino acid amide - 3-aroylthiophene - Alanine or derivatives - Alpha-amino acid or derivatives - Phenylpropane - Benzoyl - Thiophene carboxylic acid or derivatives - N-arylamide - 2,3,5-trisubstituted thiophene - Chlorobenzene - Halobenzene - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Thiophene - Vinylogous amide - Vinylogous halide - Secondary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Primary amine - Amine - Organic nitrogen compound - Primary aliphatic amine - Organohalogen compound - Organochloride - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.
External Descriptors
Not available