Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C(=O)CCC(=O)N1CCC(CC1)C1=NC(=CS1)C(=O)N(CCC#N)CC1=CN=CC=C1

InChIKey

InChIKey=MUYDKYMAZKDUNC-UHFFFAOYSA-N

Formula

C29H31N5O4S

Mass

545.66

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alkyl-phenylketone - Butyrophenone - N-acyl-piperidine - 2-heteroaryl carboxamide - Phenoxy compound - Anisole - Benzoyl - Methoxybenzene - Phenol ether - Aryl alkyl ketone - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Monocyclic benzene moiety - Piperidine - Pyridine - Benzenoid - Thiazole - Tertiary carboxylic acid amide - Azole - Heteroaromatic compound - Carboxamide group - Azacycle - Ether - Carboxylic acid derivative - Nitrile - Organoheterocyclic compound - Carbonitrile - Cyanide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organic oxide - 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

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