Structure Information
Structure

Compound Identification

SMILES

COC1=CC(OC)=CC(NC2=C(C(N)=O)C3=NC(=NN3C(N[C@@H]3CCCC[C@@H]3N)=N2)C2=CC=CC=C2)=C1

InChIKey

InChIKey=QMTFEPLRHYDWQT-VQTJNVASSA-N

Formula

C26H30N8O3

Mass

502.579

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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-1,2,4-triazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenyl-1,2,4-triazole - Dimethoxybenzene - M-dimethoxybenzene - Pyrimidinecarboxamide - Pyrimidine-5-carboxylic acid or derivatives - Triazolopyrimidine - Methoxyaniline - Methoxybenzene - Phenoxy compound - Aniline or substituted anilines - Anisole - Phenol ether - Aminopyrimidine - Cyclohexylamine - Alkyl aryl ether - Imidolactam - Benzenoid - Monocyclic benzene moiety - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Carboxamide group - Primary carboxylic acid amide - Ether - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Primary aliphatic amine - Amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Primary amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenyl-1,2,4-triazoles. These are organic compounds containing a 1,2,4-triazole substituted by a phenyl group.

External Descriptors

Not available

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