Compound Identification
SMILES
CC1=C2C(=CC=C1)C=C(CN1N=C(C3C1N=CN=C3N)C1=CC3=C(OC(N)=N3)C=C1)N(C1=CC=CC=C1)C2=O
InChIKey
InChIKey=TXCLYBFUCMVOFV-UHFFFAOYSA-N
Formula
C29H24N8O2
Mass
516.565
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
Pyrazolopyrimidines Benzoxazoles Pyridinones Benzene and substituted derivatives Hydropyrimidines Imidolactams Pyrazolines Pyrazoles Oxazoles Heteroaromatic compounds Lactams Hydrazones Oxacyclic compounds Carboximidamides Carboxamidines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxides Organooxygen compounds Hydrocarbon derivatives Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Benzoxazole - Pyrazolopyrimidine - Pyridinone - Monocyclic benzene moiety - Hydropyrimidine - 5,6-dihydropyrimidine - Pyridine - Imidolactam - Pyrimidine - Benzenoid - Azole - Heteroaromatic compound - Oxazole - Pyrazole - Pyrazoline - Lactam - Carboximidamide - Amidine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Oxacycle - Carboxylic acid amidine - Hydrazone - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary amine - 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