Compound Identification
SMILES
CCOC1=CC=CC(=C1)C(=O)C1=C(N)N=C(NC2=CC=C(OCCN3CCCC3)C=C2)S1
InChIKey
InChIKey=YWAKBDMZSWBMMS-UHFFFAOYSA-N
Formula
C24H28N4O3S
Mass
452.57
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
2,4,5-trisubstituted thiazoles Aniline and substituted anilines Phenoxy compounds Phenol ethers Benzoyl derivatives Alkyl aryl ethers 2-amino-1,3-thiazoles Imidolactams N-alkylpyrrolidines Heteroaromatic compounds Vinylogous amides Trialkylamines Azacyclic compounds Organic oxides Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - 2,4,5-trisubstituted 1,3-thiazole - Phenoxy compound - Benzoyl - Phenol ether - Aniline or substituted anilines - Alkyl aryl ether - 1,3-thiazolamine - Monocyclic benzene moiety - N-alkylpyrrolidine - Benzenoid - Imidolactam - 1,3-thiazol-2-amine - Azole - Thiazole - Pyrrolidine - Vinylogous amide - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organoheterocyclic compound - Ether - Organic oxide - Organic nitrogen compound - Primary amine - Hydrocarbon derivative - Amine - Organonitrogen compound - 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