Compound Identification
SMILES
CSC1=C(C=CC=N1)C(=O)OC1=C(Cl)C=C(Br)C=C1C
InChIKey
InChIKey=CTSQFPVDAPRGFH-UHFFFAOYSA-N
Formula
C14H11BrClNO2S
Mass
372.66
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Phenol esters
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol esters
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenol esters
Alternative Parents
Pyridinecarboxylic acids Phenoxy compounds Toluenes Alkylarylthioethers Bromobenzenes Chlorobenzenes Vinylogous thioesters Aryl bromides Aryl chlorides Heteroaromatic compounds Carboxylic acid esters Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Organochlorides Organonitrogen compounds Organooxygen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenol ester - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Phenoxy compound - Aryl thioether - Bromobenzene - Chlorobenzene - Halobenzene - Toluene - Alkylarylthioether - Monocyclic benzene moiety - Aryl halide - Pyridine - Vinylogous thioester - Aryl bromide - Aryl chloride - Heteroaromatic compound - Carboxylic acid ester - Sulfenyl compound - Thioether - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenol esters. These are aromatic compounds containing a benzene ring substituted by a hydroxyl group and an ester group.
External Descriptors
Not available