Structure Information
Structure

Compound Identification

SMILES

BrC1=CC(=CNNC(=O)C2=NN(C(=N2)C2=CC=CC=C2)C2=CC=CC=C2)C(=O)C(Br)=C1

InChIKey

InChIKey=XLJLIZRHNNQLFK-UHFFFAOYSA-N

Formula

C22H15Br2N5O2

Mass

541.203

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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 heteromonocyclic compounds

Substituents

Phenyl-1,2,4-triazole - O-quinomethane - Quinomethane - Monocyclic benzene moiety - Benzenoid - Alpha-haloketone - Heteroaromatic compound - Vinylogous amide - Carboxylic acid hydrazide - Ketone - Cyclic ketone - Carboxylic acid derivative - Azacycle - Vinyl bromide - Vinyl halide - Bromoalkene - Haloalkene - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Aromatic heteromonocyclic 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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