Compound Identification
SMILES
COC1=C(C=C(F)C=C1)C(=O)C1=CN=C(NC2CCN(CC2)S(=O)(=O)CCCN[C@@H](CO)C(C)C)N=C1N
InChIKey
InChIKey=TXDYKMRNARWETA-NRFANRHFSA-N
Formula
C25H37FN6O5S
Mass
552.67
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
Pyrimidinecarboxylic acids and derivatives Anisoles Benzoyl derivatives Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Fluorobenzenes Aminopyrimidines and derivatives Piperidines Aryl fluorides Organosulfonamides Organic sulfonamides Imidolactams Sulfonyls Vinylogous amides Heteroaromatic compounds 1,2-aminoalcohols Dialkylamines Azacyclic compounds Organofluorides Primary alcohols Organic oxides Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - Pyrimidine-5-carboxylic acid or derivatives - Phenoxy compound - Anisole - Benzoyl - Methoxybenzene - Phenol ether - Alkyl aryl ether - Aminopyrimidine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Piperidine - Imidolactam - Pyrimidine - Organic sulfonic acid amide - Organosulfonic acid amide - Benzenoid - Sulfonyl - Organosulfonic acid or derivatives - Vinylogous amide - Organic sulfonic acid or derivatives - Heteroaromatic compound - 1,2-aminoalcohol - Secondary amine - Secondary aliphatic amine - Ether - Azacycle - Organoheterocyclic compound - Primary amine - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Organosulfur compound - Primary alcohol - Amine - Organohalogen compound - Organofluoride - 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