Structure Information
Structure

Compound Identification

SMILES

COP(=O)(OC)C1=C(N)[N+](C2=CC=C(Br)C=C2)=C(C2=CC=CC=C2)C(C#N)=C1SC

InChIKey

InChIKey=ALMGSPJRLKBNAR-UHFFFAOYSA-O

Formula

C21H20BrN3O3PS

Mass

505.35

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyridines and derivatives

Subclass

Phenylpyridines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyridines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-phenylpyridine - Aryl thioether - 3-pyridinecarbonitrile - Aminopyridine - Bromobenzene - Halobenzene - Alkylarylthioether - Phosphonic acid diester - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Phosphonic acid ester - Pyridinium - Benzenoid - Heteroaromatic compound - Organophosphonic acid derivative - Azacycle - Thioether - Sulfenyl compound - Carbonitrile - Nitrile - Organooxygen compound - Organonitrogen compound - Organobromide - Organic nitrogen compound - Organohalogen compound - Cyanide - Organic oxygen compound - Hydrocarbon derivative - Organophosphorus compound - Organosulfur compound - Organic oxide - Amine - Primary amine - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyridines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyridine ring through a CC or CN bond.

External Descriptors

Not available

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