Compound Identification
SMILES
COC1=C(C=CC(=C1)C(F)(F)F)C(=O)C1=CN=C(NC2CCN(CC2)S(C)(=O)=O)N=C1N
InChIKey
InChIKey=WHVSULGUTSFAHY-UHFFFAOYSA-N
Formula
C19H22F3N5O4S
Mass
473.47
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
Trifluoromethylbenzenes Pyrimidinecarboxylic acids and derivatives Anisoles Benzoyl derivatives Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Aminopyrimidines and derivatives Piperidines Imidolactams Organosulfonamides Organic sulfonamides Heteroaromatic compounds Vinylogous amides Sulfonyls Azacyclic compounds Alkyl fluorides Hydrocarbon derivatives Organic oxides Primary amines Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - Trifluoromethylbenzene - Pyrimidine-5-carboxylic acid or derivatives - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Benzoyl - Alkyl aryl ether - Aminopyrimidine - Piperidine - Monocyclic benzene moiety - Pyrimidine - Organic sulfonic acid amide - Organosulfonic acid amide - Imidolactam - Benzenoid - Organic sulfonic acid or derivatives - Sulfonyl - Heteroaromatic compound - Organosulfonic acid or derivatives - Vinylogous amide - Azacycle - Organoheterocyclic compound - Ether - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organonitrogen compound - Organosulfur compound - Primary amine - 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