Compound Identification
SMILES
OC1CCCN(CC(=O)NC2=C(C(=O)C3=CC(Cl)=CC=C3)C3=C(COCC3)S2)C1
InChIKey
InChIKey=VQIDVRCWHXVWFK-UHFFFAOYSA-N
Formula
C21H23ClN2O4S
Mass
434.94
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 Thienopyrans Thiophene carboxylic acids and derivatives Benzoyl derivatives N-arylamides Chlorobenzenes Aryl chlorides Pyrans Piperidines Vinylogous amides Heteroaromatic compounds 1,2-aminoalcohols Trialkylamines Secondary carboxylic acid amides Secondary alcohols Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aryl-phenylketone - Alpha-amino acid amide - 3-aroylthiophene - Alpha-amino acid or derivatives - Thienopyran - Benzoyl - Thiophene carboxylic acid or derivatives - N-arylamide - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Piperidine - Pyran - Heteroaromatic compound - Thiophene - Vinylogous amide - Tertiary amine - Secondary carboxylic acid amide - Secondary alcohol - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - 1,2-aminoalcohol - Oxacycle - Azacycle - Ether - Dialkyl ether - Carboxylic acid derivative - Organoheterocyclic compound - Organic nitrogen compound - Organic oxide - Organohalogen compound - Hydrocarbon derivative - Alcohol - Organochloride - Organonitrogen compound - Amine - Aromatic heteropolycyclic 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