Compound Identification
SMILES
COCSC1=NC=CN1C1=CC=CC(=C1)C(=O)CC(=O)NC1=C(NC(O)=O)C=CC(=C1)C1=CC=CC=C1F
InChIKey
InChIKey=OAFJSEDQCPZLAW-UHFFFAOYSA-N
Formula
C27H23FN4O5S
Mass
534.56
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 Alkyl-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
Alkyl-phenylketones
Alternative Parents
Biphenyls and derivatives Phenylimidazoles Phenylcarbamic acids Anilides Aryl thioethers Benzoyl derivatives Aryl alkyl ketones N-arylamides Fluorobenzenes 1,3-dicarbonyl compounds N-substituted imidazoles Fatty amides Aryl fluorides Monothioacetals Heteroaromatic compounds Secondary carboxylic acid amides Carbamic acids Sulfenyl compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Biphenyl - 1-phenylimidazole - Phenylcarbamic acid - Anilide - Aryl thioether - N-arylamide - Benzoyl - Aryl alkyl ketone - Halobenzene - Fluorobenzene - N-substituted imidazole - Aryl fluoride - Aryl halide - Fatty amide - Benzenoid - 1,3-dicarbonyl compound - Fatty acyl - Monocyclic benzene moiety - Imidazole - Azole - Heteroaromatic compound - Monothioacetal - Carbamic acid - Carbamic acid derivative - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organosulfur compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available