Compound Identification
SMILES
CS(=O)(=O)NC1=CN=C(OC2=CC3=C(OC(CC3)C3=CC=C(F)C=C3)C=C2)C=C1
InChIKey
InChIKey=VEDJKSPBAURNOE-UHFFFAOYSA-N
Formula
C21H19FN2O4S
Mass
414.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
- Subclass Flavans
-
Class
Flavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavans
Intermediate Tree Nodes
Not available
Direct Parent
Flavans
Alternative Parents
Diarylethers 1-benzopyrans Alkyl aryl ethers Fluorobenzenes Pyridines and derivatives Organosulfonamides Organic sulfonamides Aryl fluorides Aminosulfonyl compounds Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flavan - Diaryl ether - Chromane - Benzopyran - 1-benzopyran - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyridine - Organic sulfonic acid amide - Organosulfonic acid amide - Benzenoid - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Heteroaromatic compound - Organoheterocyclic compound - Azacycle - Ether - Oxacycle - Organic nitrogen compound - Organohalogen compound - Hydrocarbon derivative - Organofluoride - Organic oxide - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavans. These are compounds containing a flavan moiety, with a structure characterized by a 2-phenyl-3,4-dihydro-2H-1-benzopyran skeleton.
External Descriptors
Not available