Compound Identification
SMILES
ClC1=CC=CC=C1C(=O)C1=C(NC(=O)C2=CN=CC=C2)SC2=C1CCN(CC1=CC=CC=C1)C2
InChIKey
InChIKey=DTGQOGOXIKAPHK-UHFFFAOYSA-N
Formula
C27H22ClN3O2S
Mass
488.0
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
3-aroylthiophenes Nicotinamides Thienopyridines Thiophene carboxylic acids and derivatives Phenylmethylamines Benzylamines Benzoyl derivatives Aralkylamines Chlorobenzenes Aryl chlorides Vinylogous amides Vinylogous halides Heteroaromatic compounds Amino acids and derivatives Secondary carboxylic acid amides Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aryl-phenylketone - 3-aroylthiophene - Pyridine carboxylic acid or derivatives - Thienopyridine - Pyridinecarboxamide - Nicotinamide - Thiophene carboxylic acid or derivatives - Phenylmethylamine - Benzoyl - Benzylamine - Halobenzene - Chlorobenzene - Aralkylamine - Benzenoid - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Pyridine - Heteroaromatic compound - Vinylogous amide - Vinylogous halide - Thiophene - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - 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