Structure Information
Structure

Compound Identification

SMILES

COC1=C(Br)C=C(F)C(=C1)N1C(=O)N2CCCCN2C1=O

InChIKey

InChIKey=ATDWCGOWAVPYAV-UHFFFAOYSA-N

Formula

C13H13BrFN3O3

Mass

358.167

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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 - Triazolopyridazine - Methoxyaniline - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Fluorobenzene - Halobenzene - Urazole - Pyridazine - Benzenoid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Aryl bromide - Heteroaromatic compound - Azacycle - Ether - Organic oxide - Organohalogen compound - Organic nitrogen compound - Organobromide - Organofluoride - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

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

External Descriptors

Not available

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