Compound Identification
SMILES
CNS(=O)(=O)NC1=CC(CC2=C(C)C3=C(OC2=O)C=C(OC(=O)N(C)C)C(C)=C3)=NC=C1
InChIKey
InChIKey=MGQRMXXEZZEACZ-UHFFFAOYSA-N
Formula
C21H24N4O6S
Mass
460.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarins and derivatives
Alternative Parents
1-benzopyrans Pyranones and derivatives Sulfuric acid diamides Pyridines and derivatives Benzenoids Heteroaromatic compounds Carbamate esters Lactones Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - Pyranone - Sulfuric acid diamide - Pyran - Pyridine - Benzenoid - Carbamic acid ester - Organic sulfuric acid or derivatives - Heteroaromatic compound - Lactone - Organoheterocyclic compound - Azacycle - Oxacycle - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one).
External Descriptors
Not available