Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)N1C=C(CN2C(=O)C3(C4=CC=CC=C24)C(C#N)=C(N)OC2=C3C(=O)N(C)C(=O)N2C)N=N1

InChIKey

InChIKey=KEAPQEPYIJZKGS-UHFFFAOYSA-N

Formula

C27H22N8O5

Mass

538.524

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Triazoles

Intermediate Tree Nodes

Phenyltriazoles

Direct Parent

Phenyl-1,2,3-triazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenyl-1,2,3-triazole - Pyranopyridine - Pyranopyrimidine - Indole or derivatives - Methoxyaniline - Anisole - Phenol ether - Phenoxy compound - Methoxybenzene - Pyrimidone - Alkyl aryl ether - Monocyclic benzene moiety - Pyridine - Pyrimidine - Benzenoid - Tertiary carboxylic acid amide - Heteroaromatic compound - Vinylogous amide - Vinylogous ester - Urea - Carboxamide group - Ketene acetal or derivatives - Lactam - Oxacycle - Azacycle - Carboxylic acid derivative - Ether - Carbonitrile - Nitrile - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Cyanide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenyl-1,2,3-triazoles. These are organic compounds containing a 1,2,3-triazole substituted by a phenyl group.

External Descriptors

Not available

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