Compound Identification
SMILES
CCOC(=S)[C@@H]1[C@@H](C)C(Cl)(Cl)C[C@H]1C(=O)OC(C)(C)C
InChIKey
InChIKey=OKCKKUBAHWAESW-OPRDCNLKSA-N
Formula
C14H22Cl2O3S
Mass
341.29
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
Carboxylic acid esters Carbothioic O-esters Monocarboxylic acids and derivatives Thiocarbonyl compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
Carboxylic acid ester - Thiocarboxylic acid ester - Carbothioic o-ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Thiocarbonyl group - Organosulfur compound - Organooxygen compound - Organochloride - Organohalogen compound - Alkyl chloride - Organic oxygen compound - Carbonyl group - Alkyl halide - Organic oxide - Hydrocarbon derivative - 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