Compound Identification
SMILES
COC1=CC=C(C=C1)C(=O)C1=C(N)C(C(=S)NC2=CC=CC=C2)=C(NC2=CC=C(Cl)C=C2)N1
InChIKey
InChIKey=AOZUNSNYSQOEEK-UHFFFAOYSA-N
Formula
C25H21ClN4O2S
Mass
476.98
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
-
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
Aniline and substituted anilines Anisoles Benzoyl derivatives Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Chlorobenzenes Aryl chlorides Substituted pyrroles Heteroaromatic compounds Thioamides Vinylogous amides Secondary amines Thiocarboxylic acid amides Azacyclic compounds Organic oxides Hydrocarbon derivatives Thiocarbonyl compounds Organochlorides Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - Phenoxy compound - Anisole - Methoxybenzene - Aniline or substituted anilines - Benzoyl - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Vinylogous amide - Pyrrole - Thioamide - Thiocarboxylic acid amide - Ether - Organoheterocyclic compound - Azacycle - Secondary amine - Thiocarbonyl group - Organosulfur compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organic oxide - Aromatic heteromonocyclic 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