Compound Identification
SMILES
BrC1=CC=CC(=C1)C(=O)OC1=CC=C(C=C2C(=O)NC(=S)NC2=O)C=C1
InChIKey
InChIKey=XBVCLDGYCFQVLW-UHFFFAOYSA-N
Formula
C18H11BrN2O4S
Mass
431.26
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
3-halobenzoic acids and derivatives Phenol esters Benzoic acid esters Thiobarbituric acid derivatives Phenoxy compounds Benzoyl derivatives Bromobenzenes Aryl bromides Diazinanes Carboxylic acid esters Thioureas Azacyclic compounds Carbonyl compounds Organic oxides Organobromides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Depside backbone - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Phenol ester - Benzoate ester - Benzoic acid or derivatives - Thiobarbiturate - Phenoxy compound - Benzoyl - Halobenzene - Bromobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - 1,3-diazinane - Benzenoid - Thiourea - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Organobromide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic 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