Compound Identification
SMILES
NC1=C(C(=O)C2=CC=CC=C2)C(=C(Br)S1)C1=CC=C(C=C1)C(F)(F)F
InChIKey
InChIKey=HASMWTVLMNBFSX-UHFFFAOYSA-N
Formula
C18H11BrF3NOS
Mass
426.25
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
-
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-amino-3-benzoylthiophenes Trifluoromethylbenzenes 3,4,5-trisubstituted-2-aminothiophenes Thiophene carboxylic acids and derivatives Benzoyl derivatives Aryl bromides Vinylogous amides Heteroaromatic compounds Primary amines Organofluorides Organobromides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-amino-3-benzoylthiophene - Aryl-phenylketone - 3-aroylthiophene - Trifluoromethylbenzene - 3,4,5-trisubstituted-2-aminothiophene - Benzoyl - Thiophene carboxylic acid or derivatives - 2-aminothiophene - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Vinylogous amide - Heteroaromatic compound - Thiophene - Organoheterocyclic compound - Organic oxide - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Alkyl fluoride - Primary amine - Alkyl halide - Organic nitrogen compound - Amine - Hydrocarbon derivative - 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