Structure Information
Structure

Compound Identification

SMILES

CC(=O)SC1(CC#N)CC1

InChIKey

InChIKey=QNMULMJLXHGYBR-UHFFFAOYSA-N

Formula

C7H9NOS

Mass

155.22

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Thiocarboxylic acids and derivatives

Subclass

Thioesters

Intermediate Tree Nodes

Not available

Direct Parent

Thioesters

Alternative Parents

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

Thiocarboxylic acid ester - Carbothioic s-ester - Carboxylic acid derivative - Carbonitrile - Nitrile - Sulfenyl compound - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Aliphatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as thioesters. These are organic compounds containing an ester of thiocarboxylic acid, with the general structure RC(=S)XR' (R=H, alkyl, aryl; R'=alkyl, aryl; X=O,S).

External Descriptors

Not available

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