Compound Identification
SMILES
CN1CCN(CC1)C1=CC=C(NC2=NC(N)=C(S2)C(=O)C2=CC=C(O)C=C2)C=C1
InChIKey
InChIKey=FPHKCFHCDTXHLO-UHFFFAOYSA-N
Formula
C21H23N5O2S
Mass
409.51
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
Phenylpiperazines N-arylpiperazines 2,4,5-trisubstituted thiazoles Dialkylarylamines Benzoyl derivatives Aniline and substituted anilines 1-hydroxy-2-unsubstituted benzenoids N-methylpiperazines Imidolactams 2-amino-1,3-thiazoles Vinylogous amides Heteroaromatic compounds Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - Phenylpiperazine - N-arylpiperazine - 2,4,5-trisubstituted 1,3-thiazole - Benzoyl - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - 1-hydroxy-2-unsubstituted benzenoid - Phenol - N-methylpiperazine - N-alkylpiperazine - 1,3-thiazol-2-amine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - 1,3-thiazolamine - Benzenoid - Imidolactam - Vinylogous amide - Thiazole - Azole - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Primary amine - Organic oxide - Amine - Organonitrogen compound - Organic nitrogen 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