Compound Identification
SMILES
CCNCCCOC1=CC=C(NC2=NC(N)=C(S2)C(=O)C2=CC(F)=C(OC)C=C2)C=C1
InChIKey
InChIKey=KACFBTLJESYLDN-UHFFFAOYSA-N
Formula
C22H25FN4O3S
Mass
444.53
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 Anisoles Benzoyl derivatives Methoxybenzenes Phenoxy compounds Fluorobenzenes Alkyl aryl ethers Imidolactams 2-amino-1,3-thiazoles Aryl fluorides Heteroaromatic compounds Vinylogous amides Dialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - 2,4,5-trisubstituted 1,3-thiazole - Phenoxy compound - Anisole - Benzoyl - Methoxybenzene - Aniline or substituted anilines - Phenol ether - Alkyl aryl ether - Fluorobenzene - Halobenzene - 1,3-thiazolamine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - 1,3-thiazol-2-amine - Benzenoid - Imidolactam - Vinylogous amide - Thiazole - Azole - Heteroaromatic compound - Secondary amine - Organoheterocyclic compound - Secondary aliphatic amine - Ether - Azacycle - Organohalogen compound - Amine - Organic oxide - Primary amine - Organic nitrogen compound - Hydrocarbon derivative - Organofluoride - 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