Compound Identification
SMILES
CCCC1=CC(C(=O)C2=CC=C(OC(F)(F)F)C=C2)=C(NC(=O)CSCC(O)=O)S1
InChIKey
InChIKey=HSWBDYKYLPDTKW-UHFFFAOYSA-N
Formula
C19H18F3NO5S2
Mass
461.47
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
3-aroylthiophenes 2,3,5-trisubstituted thiophenes Benzoyl derivatives N-arylamides Phenol ethers Phenoxy compounds Thiophene carboxylic acids and derivatives Heteroaromatic compounds Vinylogous amides Secondary carboxylic acid amides Trihalomethanes Monocarboxylic acids and derivatives Carboxylic acids Sulfenyl compounds Dialkylthioethers Organofluorides Organic oxides Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - 3-aroylthiophene - Phenoxy compound - Benzoyl - Phenol ether - Thiophene carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - N-arylamide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Vinylogous amide - Thiophene - Trihalomethane - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Thioether - Dialkylthioether - Sulfenyl compound - Organofluoride - Organohalogen compound - Alkyl halide - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Halomethane - Alkyl fluoride - 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