Compound Identification
SMILES
ClC1=CC=C(C=C1)C(=O)OC1=CC=C(C=C(C#N)C2=NC3=CC=CC=C3S2)C=C1
InChIKey
InChIKey=UJDRQNZDXREOBS-UHFFFAOYSA-N
Formula
C23H13ClN2O2S
Mass
416.88
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Depsides and depsidones
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Depsides and depsidones
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Depsides and depsidones
Alternative Parents
4-halobenzoic acids and derivatives Phenol esters Benzoic acid esters Benzothiazoles Phenoxy compounds Benzoyl derivatives Chlorobenzenes Aryl chlorides Thiazoles Heteroaromatic compounds Carboxylic acid esters Nitriles Azacyclic compounds Organic oxides Organochlorides Hydrocarbon derivatives Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Depside backbone - Phenol ester - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoate ester - 1,3-benzothiazole - Benzoic acid or derivatives - Benzoyl - Phenoxy compound - Halobenzene - Chlorobenzene - Benzenoid - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Azole - Thiazole - Heteroaromatic compound - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Nitrile - Carbonitrile - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Cyanide - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as depsides and depsidones. These are polycyclic compounds that is either a polyphenolic compound composed of two or more monocyclic aromatic units linked by an ester bond (depside), or a compound containing the depsidone structure (depsidone).
External Descriptors
Not available