Compound Identification
SMILES
COC1=C(C=C(C)C=C1)N1C(SCC(=O)C2=CC=C(F)C=C2)=NN=C1C1=CC=CS1
InChIKey
InChIKey=MTOGEXLOOBQKFC-UHFFFAOYSA-N
Formula
C22H18FN3O2S2
Mass
439.52
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
Phenyl-1,2,4-triazoles Methoxyanilines Anisoles Aryl alkyl ketones Benzoyl derivatives Methoxybenzenes Phenoxy compounds Alkylarylthioethers Toluenes Fluorobenzenes Alkyl aryl ethers Aryl fluorides Heteroaromatic compounds Thiophenes Azacyclic compounds Sulfenyl compounds Organic oxides Hydrocarbon derivatives Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Phenyltriazole - Phenyl-1,2,4-triazole - Methoxyaniline - Anisole - Phenoxy compound - Aryl thioether - Benzoyl - Phenol ether - Methoxybenzene - Aryl alkyl ketone - Alkyl aryl ether - Fluorobenzene - Halobenzene - Toluene - Alkylarylthioether - Aryl halide - Aryl fluoride - Benzenoid - Monocyclic benzene moiety - 1,2,4-triazole - Triazole - Thiophene - Heteroaromatic compound - Azole - Sulfenyl compound - Organoheterocyclic compound - Thioether - Azacycle - Ether - Organic oxide - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organofluoride - 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