Compound Identification
SMILES
CNS(=O)(=O)NC1=NC=CC(CC2=C(C)C3=CC(F)=C(OC(=O)N(C)C)C=C3OC2=O)=C1F
InChIKey
InChIKey=VQPFUKRDDYVQID-UHFFFAOYSA-N
Formula
C20H20F2N4O6S
Mass
482.46
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 Aryl fluorides Benzenoids Imidolactams Carbamate esters Heteroaromatic compounds Tertiary amines Lactones Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organofluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - Pyranone - Aryl fluoride - Aryl halide - Sulfuric acid diamide - Imidolactam - Benzenoid - Pyran - Pyridine - Heteroaromatic compound - Organic sulfuric acid or derivatives - Carbamic acid ester - Lactone - Tertiary amine - Azacycle - Oxacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen 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