Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

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

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

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