Structure Information
Structure

Compound Identification

SMILES

CC1=CC(\C=C\C#N)=CC(C)=C1NC1=NC(NC2=CC=C(C=C2)C#N)=NC(CN2C=CN=C2)=C1

InChIKey

InChIKey=QAXRJHCTONXZQO-ONEGZZNKSA-N

Formula

C26H22N8

Mass

446.518

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzonitriles

Intermediate Tree Nodes

Not available

Direct Parent

Benzonitriles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

M-xylene - Xylene - Benzonitrile - Aniline or substituted anilines - Styrene - Aminopyrimidine - N-substituted imidazole - Imidolactam - Pyrimidine - Azole - Heteroaromatic compound - Imidazole - Azacycle - Organoheterocyclic compound - Carbonitrile - Nitrile - Secondary amine - Amine - Organic nitrogen compound - Cyanide - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.

External Descriptors

Not available

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