Compound Identification
SMILES
FC1=CC=C(C=C1)N1C(SC2=CC3=CC=CC=C3OC2=O)=NC2=CC=CC=C2C1=O
InChIKey
InChIKey=AZKSZAPMIMZBFF-UHFFFAOYSA-N
Formula
C23H13FN2O3S
Mass
416.43
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
Diarylthioethers 1-benzopyrans Quinazolines Pyrimidones Pyranones and derivatives Fluorobenzenes Aryl fluorides Heteroaromatic compounds Lactams Lactones Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organooxygen compounds Organofluorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Diarylthioether - Coumarin - Quinazoline - 1-benzopyran - Benzopyran - Aryl thioether - Pyrimidone - Pyranone - Halobenzene - Fluorobenzene - Benzenoid - Aryl halide - Pyrimidine - Monocyclic benzene moiety - Aryl fluoride - Pyran - Heteroaromatic compound - Lactam - Lactone - Organoheterocyclic compound - Azacycle - Oxacycle - Sulfenyl compound - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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