Compound Identification
SMILES
CCOC(=O)C(\Br)=C\SCCN
InChIKey
InChIKey=HUHVQALQEFKBEH-WAYWQWQTSA-N
Formula
C7H12BrNO2S
Mass
254.14
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 Alpha-halocarboxylic acid derivatives Thioenol ethers Amino acids and derivatives Vinyl bromides Sulfenyl compounds Monocarboxylic acids and derivatives Bromoalkenes Organopnictogen compounds Organobromides Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic acyclic compounds
Substituents
Vinylogous thioester - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Amino acid or derivatives - Carboxylic acid ester - Thioenolether - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Vinyl bromide - Vinyl halide - Sulfenyl compound - Bromoalkene - Haloalkene - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Primary aliphatic amine - Organic oxide - Primary amine - Hydrocarbon derivative - Organic oxygen compound - Amine - Organopnictogen compound - Carbonyl group - 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