Structure Information
Structure

Compound Identification

SMILES

CC1=C2N=C(NC3=NC=NC(NC4=CC=CC5=C4N=CC=C5)=C3[N+]([O-])=O)SC2=CC=C1

InChIKey

InChIKey=KGYOKNFHKAEWHE-UHFFFAOYSA-N

Formula

C21H15N7O2S

Mass

429.46

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Quinolines and derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Quinolines and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Quinoline - 1,3-benzothiazole - Nitroaromatic compound - Aminopyrimidine - Pyridine - Pyrimidine - 1,3-thiazol-2-amine - Imidolactam - Benzenoid - Azole - Heteroaromatic compound - Thiazole - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Secondary amine - Azacycle - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic zwitterion - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as quinolines and derivatives. These are compounds containing a quinoline moiety, which consists of a benzene ring fused to a pyrimidine ring to form benzo[b]azabenzene.

External Descriptors

Not available

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