Compound Identification
SMILES
COC1=C(F)C(F)=C(F)C=C1C(=O)C1=CN=C(NC2CCN(CC2)S(C)(=O)=O)N=C1N
InChIKey
InChIKey=SNANURCXNCBFIA-UHFFFAOYSA-N
Formula
C18H20F3N5O4S
Mass
459.44
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
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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
Aryl-phenylketones
Alternative Parents
Pyrimidinecarboxylic acids and derivatives Anisoles Benzoyl derivatives Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Fluorobenzenes Aminopyrimidines and derivatives Aryl fluorides Organosulfonamides Organic sulfonamides Imidolactams Piperidines Heteroaromatic compounds Vinylogous amides Sulfonyls Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - Pyrimidine-5-carboxylic acid or derivatives - Phenol ether - Benzoyl - Methoxybenzene - Anisole - Phenoxy compound - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aminopyrimidine - Pyrimidine - Monocyclic benzene moiety - Imidolactam - Benzenoid - Organosulfonic acid amide - Aryl halide - Aryl fluoride - Piperidine - Organic sulfonic acid amide - Heteroaromatic compound - Vinylogous amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Ether - Organoheterocyclic compound - Azacycle - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic nitrogen compound - Organofluoride - 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