Structure Information
Structure

Compound Identification

SMILES

OC1=CC(SC[C@@H]2CCCC[C@H]2C(=O)NCC#N)=CC=C1

InChIKey

InChIKey=ZZMQUHKNSLYCST-SWLSCSKDSA-N

Formula

C16H20N2O2S

Mass

304.41

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organosulfur compounds

Class

Thioethers

Subclass

Aryl thioethers

Intermediate Tree Nodes

Not available

Direct Parent

Aryl thioethers

Alternative Parents

Thiophenol ethers Alkylarylthioethers 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Secondary carboxylic acid amides Sulfenyl compounds Nitriles Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Aryl thioether - Thiophenol ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Carbonitrile - Nitrile - Sulfenyl compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group.

External Descriptors

Not available

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