Structure Information
Structure

Compound Identification

SMILES

C\C(NC1=C(C(=O)C2=CC=C(C)C=C2)C2=C(CCCC2)S1)=C(\C#N)C(N)=O

InChIKey

InChIKey=ZOMKXNJETTUNRI-DTQAZKPQSA-N

Formula

C21H21N3O2S

Mass

379.48

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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

Aryl-phenylketones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aryl-phenylketone - 2-amino-3-benzoylthiophene - 3-aroylthiophene - 3,4,5-trisubstituted-2-aminothiophene - Benzoyl - Thiophene carboxylic acid or derivatives - Toluene - Monocyclic benzene moiety - Benzenoid - 2-aminothiophene - Vinylogous amide - Heteroaromatic compound - Thiophene - Carboxamide group - Primary carboxylic acid amide - Organoheterocyclic compound - Nitrile - Carbonitrile - Enamine - Carboxylic acid derivative - Cyanide - Organonitrogen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic 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

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