Compound Identification
SMILES
FC1=CC=C(C=C1)C1CC(=NN1C(=O)COC1=CC=CC2=C1CCN(CC1=CN=CC=C1)C2=O)C1=CC=CS1
InChIKey
InChIKey=GBZRTGXEXSITAF-UHFFFAOYSA-N
Formula
C30H25FN4O3S
Mass
540.61
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
Tetrahydroisoquinolines Phenol ethers Alkyl aryl ethers Fluorobenzenes Aryl fluorides Pyridines and derivatives Thiophenes Tertiary carboxylic acid amides Pyrazolines Heteroaromatic compounds Lactams Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Tetrahydroisoquinoline - Phenol ether - Fluorobenzene - Halobenzene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Aryl fluoride - Pyridine - Aryl halide - Heteroaromatic compound - Thiophene - Tertiary carboxylic acid amide - Pyrazoline - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Ether - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organofluoride - Organohalogen 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