Compound Identification
SMILES
CC(=O)SC1=CC=C(C=C1)C#CC1=CC(C(C=C1)=C=C=C1C=CC(=S)C=C1)=[N+](O)[O-]
InChIKey
InChIKey=BSFZMLKEBBABDW-UHFFFAOYSA-N
Formula
C24H15NO3S2
Mass
429.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Thiophenol esters
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Thiophenol esters
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thiophenol esters
Alternative Parents
Aryl thioethers Benzene and substituted derivatives Thioketones Thioesters Nitronic acids Carbothioic S-esters Sulfenyl compounds Carboxylic acids and derivatives Allyl-type 1,3-dipolar organic compounds Organonitrogen compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Thiophenol ester - Aryl thioether - Monocyclic benzene moiety - Nitronic acid - Thiocarboxylic acid ester - Thioketone - Carbothioic s-ester - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Sulfenyl compound - Thiocarboxylic acid or derivatives - Organic oxide - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Thiocarbonyl group - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic salt - Organic zwitterion - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as thiophenol esters. These are thioester derivatives of thiophenols. Thiophenol is a phenol derivative obtained by replacing the oxygen atom from the hydroxyl group (attached to the benzene) by a sulfur atom.
External Descriptors
Not available