Compound Identification
SMILES
CCNC(=S)NN=CC1=CC=C(OC(=O)C2=CC=CC=C2Br)C=C1
InChIKey
InChIKey=SDHHIBMMFVDWKO-UHFFFAOYSA-N
Formula
C17H16BrN3O2S
Mass
406.3
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
Phenol esters Benzoic acid esters 2-halobenzoic acids and derivatives Phenoxy compounds Benzoyl derivatives Bromobenzenes Thiosemicarbazones Aryl bromides Vinylogous halides Carboxylic acid esters Organosulfur compounds Organooxygen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Depside backbone - Benzoate ester - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Phenol ester - Benzoic acid or derivatives - Phenoxy compound - Benzoyl - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Thiosemicarbazone - Vinylogous halide - Carboxylic acid ester - Carboxylic acid derivative - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen 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