Compound Identification
SMILES
CNC(=O)C1=C2C(=NN1)N=CN=C2N[C@@H](C)C1=CC2=C(C(Cl)=CC=C2)C(=O)N1C1=CC=CC=C1
InChIKey
InChIKey=BOBVKWQWXLWVMK-ZDUSSCGKSA-N
Formula
C24H20ClN7O2
Mass
473.92
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
Pyrimidinecarboxamides Pyrazolo[3,4-d]pyrimidines 2-heteroaryl carboxamides Pyrazole-5-carboxamides Aminopyrimidines and derivatives Secondary alkylarylamines Pyridinones Aryl chlorides Benzene and substituted derivatives Imidolactams Heteroaromatic compounds Vinylogous halides Lactams Secondary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Pyrazolo[3,4-d]pyrimidine - Pyrazolopyrimidine - Pyrimidinecarboxamide - 2-heteroaryl carboxamide - Pyrazole-5-carboxamide - Aminopyrimidine - Pyridinone - Secondary aliphatic/aromatic amine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Imidolactam - Benzenoid - Pyrimidine - Azole - Heteroaromatic compound - Pyrazole - Vinylogous halide - Secondary carboxylic acid amide - Carboxamide group - Lactam - Amino acid or derivatives - Secondary amine - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Organochloride - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen 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