Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C1=[N+](C(SCC(=O)NN=CC2=CC(Br)=CC(Br)=C2[O-])=NN1)C1=CC=C(C)C=C1

InChIKey

InChIKey=ONEGPPDEGMVXDL-UHFFFAOYSA-N

Formula

C25H21Br2N5O3S

Mass

631.34

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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 - Phenol ether - Phenoxy compound - Aryl thioether - Anisole - Methoxybenzene - Phenoxide - Toluene - Alkyl aryl ether - Halobenzene - Alkylarylthioether - Bromobenzene - Aryl bromide - Benzenoid - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Azacycle - Carboxylic acid derivative - Ether - Sulfenyl compound - Thioether - Organobromide - Organohalogen compound - Organic zwitterion - Organic oxygen compound - Carbonyl group - Organic salt - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - 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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