Compound Identification
SMILES
NC1=C(SC2=NSC(SCC[NH+]3CCOCC3)=C12)C(=O)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=XZXZPHPYNWDAIN-UHFFFAOYSA-O
Formula
C18H19ClN3O2S3
Mass
441.0
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
Thiophene carboxylic acids and derivatives Thienothiazoles Benzoyl derivatives Alkylarylthioethers Chlorobenzenes Aminothiophenes Aryl chlorides Morpholines Vinylogous amides Thiazoles Quaternary ammonium salts Heteroaromatic compounds Trialkylamines Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organochlorides Organic oxides Primary amines Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aryl-phenylketone - Aryl thioether - Thienothiazole - Benzoyl - Thiophene carboxylic acid or derivatives - Alkylarylthioether - Chlorobenzene - Halobenzene - Aminothiophene - Aryl chloride - Aryl halide - Oxazinane - Monocyclic benzene moiety - Benzenoid - Morpholine - Thiophene - Vinylogous amide - Azole - Heteroaromatic compound - Thiazole - Quaternary ammonium salt - Tertiary aliphatic amine - Tertiary amine - Thioether - Oxacycle - Azacycle - Organoheterocyclic compound - Dialkyl ether - Ether - Sulfenyl compound - Organic nitrogen compound - Primary amine - Amine - Organohalogen compound - Organochloride - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic heteropolycyclic 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