Compound Identification
SMILES
CC(C)CN1C(SCC2=CC(=O)OC3=C2C=CC(C)=C3C)=NN=C1C1=CC=CC=C1F
InChIKey
InChIKey=JCDRGNRNOUMTEC-UHFFFAOYSA-N
Formula
C24H24FN3O2S
Mass
437.53
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
Phenyl-1,2,4-triazoles 1-benzopyrans Pyranones and derivatives Alkylarylthioethers Fluorobenzenes Aryl fluorides Heteroaromatic compounds Lactones Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds Organooxygen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyltriazole - Phenyl-1,2,4-triazole - Coumarin - 1-benzopyran - Benzopyran - Aryl thioether - Fluorobenzene - Halobenzene - Alkylarylthioether - Pyranone - Aryl halide - Benzenoid - Pyran - Aryl fluoride - Monocyclic benzene moiety - Triazole - Heteroaromatic compound - 1,2,4-triazole - Azole - Lactone - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Oxacycle - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - 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