Structure Information
Structure

Compound Identification

SMILES

NC(N)=NCCCNC1=C2C=CC=C3C(=O)N(C4=CC=CC(CCC(=O)NCCC5=CC(Cl)=CC=C5)=C4)C(=O)C(C=C1)=C23

InChIKey

InChIKey=NPUMUGUYFIYOCG-UHFFFAOYSA-N

Formula

C33H33ClN6O3

Mass

597.12

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoquinolone - Naphthalene - Halobenzene - Secondary aliphatic/aromatic amine - Chlorobenzene - Carboxylic acid imide, n-substituted - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Benzenoid - Carboxylic acid imide - Amino acid or derivatives - Guanidine - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Secondary amine - Organic oxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen 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

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