Structure Information
Structure

Compound Identification

SMILES

CC1=CN2C=C(COC(=O)C3=CC=C(C=C3)N3C=NC=N3)N=C2C=C1

InChIKey

InChIKey=NVALFAVIDBOQKW-UHFFFAOYSA-N

Formula

C18H15N5O2

Mass

333.351

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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 - Benzoate ester - Benzoic acid or derivatives - Imidazo[1,2-a]pyridine - Imidazopyridine - Benzoyl - Methylpyridine - Monocyclic benzene moiety - Benzenoid - Pyridine - N-substituted imidazole - Heteroaromatic compound - Imidazole - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - 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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