Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C(=O)OC1=C(C=NNC(=S)NC2=CC=CC(C)=C2)C=C(Br)C=C1
InChIKey
InChIKey=TWWXGQZLIYPROE-UHFFFAOYSA-N
Formula
C24H22BrN3O4S
Mass
528.42
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
M-methoxybenzoic acids and derivatives P-methoxybenzoic acids and derivatives Phenol esters Dimethoxybenzenes Benzoic acid esters Phenoxy compounds Anisoles Benzoyl derivatives Alkyl aryl ethers Bromobenzenes Toluenes Aryl bromides Thiosemicarbazones Carboxylic acid esters Organosulfur compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Depside backbone - M-methoxybenzoic acid or derivatives - P-methoxybenzoic acid or derivatives - Benzoate ester - O-dimethoxybenzene - Dimethoxybenzene - Phenol ester - Benzoic acid or derivatives - Anisole - Phenoxy compound - Benzoyl - Methoxybenzene - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Toluene - Thiosemicarbazone - Aryl halide - Aryl bromide - Monocyclic benzene moiety - Benzenoid - Carboxylic acid ester - Carboxylic acid derivative - Ether - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Organobromide - Organosulfur compound - Aromatic homomonocyclic 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