Compound Identification
SMILES
COC1=CC(=NC2=CC=CC=C12)C(=O)N1CCC(CC1)C1=NC(=CS1)C(=O)NCC(=O)C1=CC=CC=C1
InChIKey
InChIKey=FMEHWINNELJQFR-UHFFFAOYSA-N
Formula
C28H26N4O4S
Mass
514.6
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
Quinoline carboxamides N-acylpiperidines Pyridinecarboxylic acids and derivatives Thiazolecarboxamides 2-heteroaryl carboxamides Benzoyl derivatives Aryl alkyl ketones 2,4-disubstituted thiazoles Alkyl aryl ethers Heteroaromatic compounds Tertiary carboxylic acid amides Secondary carboxylic acid amides Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoline-2-carboxamide - Alkyl-phenylketone - Quinoline - N-acyl-piperidine - Pyridine carboxylic acid or derivatives - Benzoyl - 2-heteroaryl carboxamide - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - Aryl alkyl ketone - Alkyl aryl ether - 2,4-disubstituted 1,3-thiazole - Pyridine - Monocyclic benzene moiety - Piperidine - Benzenoid - Thiazole - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic 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