Structure Information
Structure

Compound Identification

SMILES

BrC1=CC=C(C=C1)C1=[N+](C(SCC(=O)NNC=C2C=C(Br)C=CC2=O)=NN1)C1=CC=CC=C1

InChIKey

InChIKey=DDSCTPIVFUAAAT-UHFFFAOYSA-O

Formula

C23H18Br2N5O2S

Mass

588.3

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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 - Aryl thioether - O-quinomethane - Quinomethane - Bromobenzene - Halobenzene - Alkylarylthioether - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Vinylogous amide - Carboxylic acid hydrazide - Ketone - Cyclic ketone - Carboxylic acid derivative - Azacycle - Bromoalkene - Haloalkene - Sulfenyl compound - Thioether - Vinyl bromide - Vinyl halide - Organohalogen compound - Organic oxide - Organic oxygen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organic cation - 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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