Compound Identification
SMILES
CC(=O)N1CCN(CC2=CC(NC3=CC4=CC=CC=C4C=N3)=NC=C2)CC1
InChIKey
InChIKey=NEOJXVNMPPELFN-UHFFFAOYSA-N
Formula
C21H23N5O
Mass
361.449
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
N-alkylpiperazines Aralkylamines Aminopyridines and derivatives Imidolactams Benzenoids Tertiary carboxylic acid amides Heteroaromatic compounds Acetamides Trialkylamines Amino acids and derivatives Secondary amines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinoline - Aminopyridine - N-alkylpiperazine - Aralkylamine - 1,4-diazinane - Piperazine - Pyridine - Benzenoid - Imidolactam - Heteroaromatic compound - Tertiary carboxylic acid amide - Acetamide - Amino acid or derivatives - Tertiary amine - Carboxamide group - Tertiary aliphatic amine - Secondary amine - Carboxylic acid derivative - Azacycle - Amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - 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