Structure Information
Structure

Compound Identification

SMILES

NC1=NC2=C(C=C(C=C2)S(=O)(=O)C2=CC=C(Br)C=C2)[N+]([O-])=N1

InChIKey

InChIKey=DXWHQMRKCWOUDE-UHFFFAOYSA-N

Formula

C13H9BrN4O3S

Mass

381.2

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzenesulfonyl compounds

Intermediate Tree Nodes

Not available

Direct Parent

Benzenesulfonyl compounds

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzenesulfonyl group - Aminotriazine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Triazine - 1,2,4-triazine - Sulfone - Sulfonyl - Heteroaromatic compound - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Amine - Primary amine - Organosulfur compound - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzenesulfonyl compounds. These are aromatic compounds containing a benzenesulfonyl group, which consists of a monocyclic benzene moiety that carries a sulfonyl group.

External Descriptors

Not available

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