Compound Identification
SMILES
OC1=C2NC(=O)SC2=C(CCNCCS(=O)(=O)CCCOCCC2=NC=CC3=CC=CC=C23)C=C1
InChIKey
InChIKey=JWZFCPVMYZWJCB-UHFFFAOYSA-N
Formula
C25H29N3O5S2
Mass
515.64
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
Phenethylamines Benzothiazoles Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Pyridines and derivatives Thiazoles Sulfones Heteroaromatic compounds Dialkylamines Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinoline - 1,3-benzothiazole - Phenethylamine - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aralkylamine - Pyridine - Benzenoid - Thiazole - Sulfonyl - Sulfone - Heteroaromatic compound - Azole - Azacycle - Secondary amine - Dialkyl ether - Secondary aliphatic amine - Ether - Amine - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - 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