Compound Identification
SMILES
O[C@@]1(N=C([S-])[C@@H](C#N)[C@H]([C@@H]1[N+]1=CC2=CC=CC=C2C=C1)C1=CC=NC=C1)C1=CC=CC=C1
InChIKey
InChIKey=OZLASOBYJYEZKE-UHCVVMIDSA-N
Formula
C26H20N4OS
Mass
436.53
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
Tetrahydropyridines Pyridinium derivatives Benzene and substituted derivatives Heteroaromatic compounds Cyclic imidothioic acids Propargyl-type 1,3-dipolar organic compounds Nitriles Azacyclic compounds Alkanolamines Organosulfur compounds Organooxygen compounds Organic zwitterions Organic salts Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinoline - Tetrahydropyridine - Monocyclic benzene moiety - Hydropyridine - Pyridine - Pyridinium - Benzenoid - Heteroaromatic compound - Cyclic imidothioic acid - Propargyl-type 1,3-dipolar organic compound - Azacycle - Alkanolamine - Nitrile - Carbonitrile - Organic 1,3-dipolar compound - Organic zwitterion - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organic salt - 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