Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C1=NN=C(SCC(=O)C2=CC=C(F)C=C2)C=C1
InChIKey
InChIKey=WDSCAZRMVCYEFV-UHFFFAOYSA-N
Formula
C20H17FN2O3S
Mass
384.43
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 Alkyl-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
Alkyl-phenylketones
Alternative Parents
Phenylpyridazines Dimethoxybenzenes Phenoxy compounds Anisoles Aryl alkyl ketones Benzoyl derivatives Alkyl aryl ethers Alkylarylthioethers Fluorobenzenes Aryl fluorides Heteroaromatic compounds Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Phenylpyridazine - O-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Aryl thioether - Anisole - Phenol ether - Methoxybenzene - Benzoyl - Aryl alkyl ketone - Alkyl aryl ether - Halobenzene - Fluorobenzene - Alkylarylthioether - Aryl fluoride - Benzenoid - Monocyclic benzene moiety - Aryl halide - Pyridazine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Ether - Thioether - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organosulfur compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available