Compound Identification
SMILES
O=C(COC1=CC=CC=C1C1=N\C(SS1)=C1\C=CC=CC1=O)C1=CC=CC=C1
InChIKey
InChIKey=KGTSUOHVDSEKTR-LTGZKZEYSA-N
Formula
C22H15NO3S2
Mass
405.49
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
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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
Alkyl-phenylketones
Alternative Parents
Phenoxy compounds Phenol ethers O-quinomethanes Benzoyl derivatives Aryl alkyl ketones Alkyl aryl ethers Dithiazoles Organic disulfides Ketene acetals Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Phenoxy compound - Benzoyl - O-quinomethane - Aryl alkyl ketone - Phenol ether - Quinomethane - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - 1,2,4-dithiazole - Ketene acetal or derivatives - Organic disulfide - Cyclic ketone - Organoheterocyclic compound - Ether - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - 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