Structure Information
Structure

Compound Identification

SMILES

COC1=NC=C(NC2=NC=C3N=NN(C3=N2)C2=CC=CC(CNC(=O)C34CC5CC(CC(C5)C3)C4)=C2)C=C1

InChIKey

InChIKey=VLQFJFGUCGNQNC-UHFFFAOYSA-N

Formula

C28H30N8O2

Mass

510.602

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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 - Triazolopyrimidine - Alkyl aryl ether - Aminopyridine - Aminopyrimidine - Monocyclic benzene moiety - Pyridine - Pyrimidine - Benzenoid - Heteroaromatic compound - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Secondary amine - Azacycle - Ether - Carboxylic acid derivative - Amine - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organic oxygen 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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