Compound Identification
SMILES
CC(=O)SC1(CC#N)CC1
InChIKey
InChIKey=QNMULMJLXHGYBR-UHFFFAOYSA-N
Formula
C7H9NOS
Mass
155.22
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Thiocarboxylic acids and derivatives
- Subclass Thioesters
-
Class
Thiocarboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
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
Carbothioic S-esters Sulfenyl compounds Nitriles Carboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
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