Compound Identification
SMILES
Cl.CC(C)(C)C1=CC=C(NC(=O)N[C@@H]2CCN(C2)C2=CC=CC3=C2C=CN=C3)C=C1
InChIKey
InChIKey=AJGBRGWBMIBXJW-VEIFNGETSA-N
Formula
C24H29ClN4O
Mass
424.97
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-phenylureas Phenylpropanes Dialkylarylamines Pyridines and derivatives Pyrrolidines Heteroaromatic compounds Ureas Azacyclic compounds Organic oxides Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinoline - N-phenylurea - Phenylpropane - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Monocyclic benzene moiety - Pyridine - Benzenoid - Heteroaromatic compound - Pyrrolidine - Urea - Tertiary amine - Azacycle - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrochloride - Amine - 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