Structure Information
Structure

Compound Identification

SMILES

BrC1=CC2=C(C=C1)N(CC1=NNC(=S)N1C1=CC=CC=C1)C1=NC3=CC=CC=C3N=C21

InChIKey

InChIKey=VSAMQOYOKLLXOK-UHFFFAOYSA-N

Formula

C23H15BrN6S

Mass

487.38

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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 - N-alkylindole - Quinoxaline - Indole - Indole or derivatives - Pyrrolopyrazine - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyrazine - Substituted pyrrole - Benzenoid - Pyrrole - Heteroaromatic compound - Triazoline - Azacycle - Organosulfur compound - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - 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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