Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)N1N=NC2=CN=C(N[C@H]3CCCN(C3)C(=O)OC(C)(C)C)N=C12

InChIKey

InChIKey=XAONWBNOVRQVOH-AWEZNQCLSA-N

Formula

C21H27N7O3

Mass

425.493

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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 - Piperidinecarboxylic acid - Triazolopyrimidine - Methoxyaniline - Anisole - Methoxybenzene - Phenol ether - Phenoxy compound - Alkyl aryl ether - Aminopyrimidine - 3-aminopiperidine - Monocyclic benzene moiety - Piperidine - Benzenoid - Pyrimidine - Heteroaromatic compound - Carbamic acid ester - Azacycle - Ether - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - 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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