Compound Identification
SMILES
COC1=CC(C(=O)C2=C(N)C(C3=NC(=CS3)C3=CC=C(F)C=C3)=C3C=CC=CN23)=C(OC)C=C1
InChIKey
InChIKey=GNTZWXDCMQCHAP-UHFFFAOYSA-N
Formula
C26H20FN3O3S
Mass
473.52
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
Dimethoxybenzenes Indolizines Phenoxy compounds Anisoles Benzoyl derivatives 2,4-disubstituted thiazoles Alkyl aryl ethers Fluorobenzenes Substituted pyrroles Pyridines and derivatives Aryl fluorides Vinylogous amides Heteroaromatic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aryl-phenylketone - Dimethoxybenzene - P-dimethoxybenzene - Indolizine - Pyrrolopyridine - Anisole - Benzoyl - Phenol ether - Phenoxy compound - Methoxybenzene - Alkyl aryl ether - Fluorobenzene - Halobenzene - 2,4-disubstituted 1,3-thiazole - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyridine - Substituted pyrrole - Heteroaromatic compound - Thiazole - Pyrrole - Azole - Vinylogous amide - Azacycle - Ether - Organoheterocyclic compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Primary amine - Organic oxide - Organohalogen compound - Organofluoride - 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