Compound Identification
SMILES
CCCCOC1=CC=C(C=C1)C(=O)CN1N=C(COC2=C(Cl)C=C(Cl)C=C2)OC1=S
InChIKey
InChIKey=KCHFKUQIAAESQV-UHFFFAOYSA-N
Formula
C21H20Cl2N2O4S
Mass
467.36
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 Aryl alkyl ketones Benzoyl derivatives Dichlorobenzenes Alkyl aryl ethers Aryl chlorides 1,3,4-oxadiazoles Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds Organopnictogen compounds Aldehydes Organosulfur compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - 1,3-dichlorobenzene - Phenol ether - Aryl alkyl ketone - Benzoyl - Phenoxy compound - Chlorobenzene - Alkyl aryl ether - Halobenzene - Monocyclic benzene moiety - Benzenoid - Aryl halide - Aryl chloride - Heteroaromatic compound - Azole - Oxadiazole - 1,3,4-oxadiazole - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Organosulfur compound - Organopnictogen compound - Aldehyde - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen 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