Compound Identification
SMILES
CCOC(=O)C(\C#N)=C(/S)SC
InChIKey
InChIKey=XMNDOEYOBXFILM-FNORWQNLSA-N
Formula
C7H9NO2S2
Mass
203.27
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
- Class Vinylogous thioesters
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Vinylogous thioesters
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Vinylogous thioesters
Alternative Parents
Enoate esters Ketene acetals Hemiacetals Dithiohemiacetals Sulfenyl compounds Nitriles Monocarboxylic acids and derivatives Alkylthiols Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic acyclic compounds
Substituents
Vinylogous thioester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Dithiohemiacetal - Hemiacetal - Ketene acetal or derivatives - Sulfenyl compound - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Alkylthiol - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic oxide - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as vinylogous thioesters. These are organic compounds containing a thioester group, which is indirectly attached to a carbonyl via an intervening vinyl (>C=C<) moiety.
External Descriptors
Not available