Compound Identification
SMILES
COC1=C(OC)C(OC)=C2CC3=C(SC4=CC=CC=C4)C4=CC=CC=C4N3C(=O)C2=C1
InChIKey
InChIKey=OTCWCULTCMGNAG-UHFFFAOYSA-N
Formula
C25H21NO4S
Mass
431.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isoquinolines and derivatives
- Subclass Isoquinolones and derivatives
-
Class
Isoquinolines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
Isoquinolones and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Isoquinolones and derivatives
Alternative Parents
Diarylthioethers Indoles Thiophenol ethers Anisoles Alkyl aryl ethers Substituted pyrroles Benzene and substituted derivatives Heteroaromatic compounds Lactams Sulfenyl compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Diarylthioether - Indole - Indole or derivatives - Anisole - Phenol ether - Thiophenol ether - Aryl thioether - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Substituted pyrrole - Pyrrole - Heteroaromatic compound - Lactam - Sulfenyl compound - Azacycle - Ether - Thioether - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoquinolones and derivatives. These are aromatic polycyclic compounds containing a ketone bearing isoquinoline moiety.
External Descriptors
Not available