Structure Information
Structure

Compound Identification

SMILES

BrC1=CC=CC=C1C1=NN=C(SCC2=CC=CC3=CC=CC=C23)N1CC1=CC=CC=C1

InChIKey

InChIKey=JOLASEAPAGQRLR-UHFFFAOYSA-N

Formula

C26H20BrN3S

Mass

486.43

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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 - Naphthalene - Aryl thioether - Bromobenzene - Halobenzene - Alkylarylthioether - Benzenoid - Aryl bromide - Monocyclic benzene moiety - Aryl halide - Heteroaromatic compound - Sulfenyl compound - Thioether - Azacycle - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen 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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