Compound Identification
SMILES
CS(=O)(=O)N1CCC(COC2=C3C=NC=CC3=CC(=C2)C2=CC=CC(=C2)C#N)C1
InChIKey
InChIKey=DYQQYSGFIMESBE-UHFFFAOYSA-N
Formula
C22H21N3O3S
Mass
407.49
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isoquinolines and derivatives
Alternative Parents
Phenol ethers Benzonitriles Alkyl aryl ethers Pyridines and derivatives Organosulfonamides Organic sulfonamides Sulfonyls Pyrrolidines Heteroaromatic compounds Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinoline - Benzonitrile - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Pyridine - Organic sulfonic acid amide - Benzenoid - Organosulfonic acid amide - Heteroaromatic compound - Pyrrolidine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Nitrile - Carbonitrile - Azacycle - Ether - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Cyanide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoquinolines and derivatives. These are aromatic polycyclic compounds containing an isoquinoline moiety, which consists of a benzene ring fused to a pyridine ring and forming benzo[c]pyridine.
External Descriptors
Not available