Structure Information
Structure

Compound Identification

SMILES

NC1=NC=CC2=C1C=C(C=C2)N1N=C(C=C1NC(=O)C1=C(F)C=C(C=C1)C(=O)N1CCCC1)C(F)(F)F

InChIKey

InChIKey=NMUJZVUUTRSPCL-UHFFFAOYSA-N

Formula

C25H20F4N6O2

Mass

512.469

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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 - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - N-acylpyrrolidine - Aminopyridine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Pyridine - Benzenoid - Tertiary carboxylic acid amide - Pyrrolidine - Pyrazole - Azole - Vinylogous halide - Heteroaromatic compound - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Azacycle - Carboxylic acid derivative - Primary amine - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organofluoride - Organic nitrogen compound - Organonitrogen compound - Organooxygen 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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