Compound Identification
SMILES
CC1=CC(OC(=O)CSC2=NN=C(CNC(=O)C3=CC=CC=C3)O2)=C(C)C=C1
InChIKey
InChIKey=DLPNTYUTLFTBPP-UHFFFAOYSA-N
Formula
C20H19N3O4S
Mass
397.45
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
Benzamides p-Xylenes Phenoxy compounds Benzoyl derivatives Alkylarylthioethers 1,3,4-oxadiazoles Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenol ester - Benzamide - Benzoic acid or derivatives - Phenoxy compound - Aryl thioether - P-xylene - Xylene - Benzoyl - Alkylarylthioether - Monocyclic benzene moiety - 1,3,4-oxadiazole - Azole - Oxadiazole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Thioether - Azacycle - Organoheterocyclic compound - Oxacycle - Sulfenyl compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organosulfur compound - 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