Structure Information
Structure

Compound Identification

SMILES

CC1=NC(CS(=O)(=O)C2=CC=C(Br)C=C2)=C(N1CCO)[N+]([O-])=O

InChIKey

InChIKey=JJHRVXDWKJALLM-UHFFFAOYSA-N

Formula

C13H14BrN3O5S

Mass

404.24

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Imidazoles

Intermediate Tree Nodes

Substituted imidazoles - Tetrasubstituted imidazoles

Direct Parent

1,2,4,5-tetrasubstituted imidazoles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

1,2,4,5-tetrasubstituted imidazole - Benzenesulfonyl group - Nitroaromatic compound - Nitroimidazole - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Heteroaromatic compound - Sulfone - Sulfonyl - Organic nitro compound - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Alkanolamine - Azacycle - Organic 1,3-dipolar compound - Organic oxoazanium - Organic zwitterion - Organobromide - Organohalogen compound - Organonitrogen compound - Alcohol - Organic salt - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Primary alcohol - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 1,2,4,5-tetrasubstituted imidazoles. These are imidazoles in which the imidazole ring is substituted at for positions 1,2,4, and 5.

External Descriptors

Not available

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