Compound Identification
SMILES
FC(F)(F)C1=CC(NC2=NC=C(CCC3=CC(=O)NC=C3)C3=CC=CC=C23)=CC=C1
InChIKey
InChIKey=LCNYLIXLPNHWDW-UHFFFAOYSA-N
Formula
C23H18F3N3O
Mass
409.412
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
Trifluoromethylbenzenes Aniline and substituted anilines Pyridinones Dihydropyridines Aminopyridines and derivatives Imidolactams Heteroaromatic compounds Lactams Secondary amines Azacyclic compounds Organooxygen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinoline - Trifluoromethylbenzene - Aniline or substituted anilines - Aminopyridine - Dihydropyridine - Pyridinone - Imidolactam - Benzenoid - Monocyclic benzene moiety - Pyridine - Hydropyridine - Heteroaromatic compound - Lactam - Azacycle - Secondary amine - Organic oxide - Organofluoride - Organohalogen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Alkyl halide - Amine - Alkyl fluoride - Organic oxygen 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