Compound Identification
SMILES
CCOC1=C(OC(C)C)C=CC(=C1)C(NC1=CC2=C(C=C1)C(N)=NC=C2)C(=O)NS(=O)(=O)C1=CC=C(CN)C=C1
InChIKey
InChIKey=DSQCQIIRLORHQW-UHFFFAOYSA-N
Formula
C29H33N5O5S
Mass
563.67
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
Phenylacetamides Alpha amino acids and derivatives Benzenesulfonamides Benzenesulfonyl compounds Phenylmethylamines Phenoxy compounds Phenol ethers Benzylamines Secondary alkylarylamines Alkyl aryl ethers Aminopyridines and derivatives Aralkylamines Imidolactams Organosulfonic acids and derivatives Aminosulfonyl compounds Heteroaromatic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Monoalkylamines Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylacetamide - Benzenesulfonamide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Isoquinoline - Benzenesulfonyl group - Phenylmethylamine - Phenol ether - Phenoxy compound - Benzylamine - Alkyl aryl ether - Aralkylamine - Aminopyridine - Secondary aliphatic/aromatic amine - Benzenoid - Monocyclic benzene moiety - Pyridine - Imidolactam - Heteroaromatic compound - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Amino acid or derivatives - Carboxylic acid derivative - Ether - Azacycle - Secondary amine - Organic nitrogen compound - Primary aliphatic amine - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - 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