Compound Identification
SMILES
CN1N=NN=C1SC1=C(C=C(C=C1)[N+]([O-])=O)C(=O)OC1=CC=C(C=C1)C1=CC=C(C=C1)C#N
InChIKey
InChIKey=BIGKWCJFDRRECL-UHFFFAOYSA-N
Formula
C22H14N6O4S
Mass
458.45
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
Biphenylcarbonitriles Nitrobenzoic acids and derivatives Diarylthioethers Benzoic acid esters O-sulfanylbenzoic acids and derivatives Phenol esters Nitrobenzenes Benzonitriles Phenoxy compounds Benzoyl derivatives Thiophenol ethers Nitroaromatic compounds Vinylogous thioesters Heteroaromatic compounds Tetrazoles Carboxylic acid esters Nitriles Sulfenyl compounds Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organic salts Organooxygen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Depside backbone - Biphenylcarbonitrile - Nitrobenzoate - Biphenyl - Diarylthioether - Benzoate ester - O-sulfanylbenzoic acid or derivatives - Phenol ester - Nitrobenzene - Benzoic acid or derivatives - Benzonitrile - Benzoyl - Nitroaromatic compound - Aryl thioether - Phenoxy compound - Thiophenol ether - Vinylogous thioester - Benzenoid - Monocyclic benzene moiety - Azole - Heteroaromatic compound - Tetrazole - Carboxylic acid ester - Organic nitro compound - C-nitro compound - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Carboxylic acid derivative - Thioether - Organoheterocyclic compound - Carbonitrile - Nitrile - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organic oxygen compound - Cyanide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic cation - 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