Compound Identification
SMILES
CC1=C(C)C=C(C=C1)N1C(=S)SC2=C1N=C(SCC(=O)OC1=CC=CC=C1F)N(C2=O)C1=CC=CC=C1
InChIKey
InChIKey=RXNSIVFWHNGKDP-UHFFFAOYSA-N
Formula
C27H20FN3O3S3
Mass
549.65
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
o-Xylenes Phenoxy compounds Alkylarylthioethers Pyrimidones Fluorobenzenes Aryl fluorides Vinylogous amides Thiazoles Heteroaromatic compounds Carboxylic acid esters Lactams Sulfenyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organofluorides Carbonyl compounds Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenol ester - Phenoxy compound - Aryl thioether - O-xylene - Xylene - Fluorobenzene - Halobenzene - Pyrimidone - Alkylarylthioether - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Thiazole - Azole - Vinylogous amide - Heteroaromatic compound - Carboxylic acid ester - Lactam - Sulfenyl compound - Thioether - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Organic oxide - Aromatic heteropolycyclic 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