Structure Information
Structure

Compound Identification

SMILES

CC(=NNC1=NN2C=NN=C2C=C1)C1=CC=C(Br)C=C1

InChIKey

InChIKey=VFKKKTFMLUCFQM-UHFFFAOYSA-N

Formula

C13H11BrN6

Mass

331.177

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Triazolopyridazines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Triazolopyridazines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Triazolopyridazine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyridazine - Benzenoid - Imidolactam - Azole - 1,2,4-triazole - Heteroaromatic compound - Hydrazone - Azacycle - 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 triazolopyridazines. These are polycyclic compounds containing a triazole fused to a pyridazine. Triazole is a five-membered ring consisting of two carbon atoms and three nitrogen atoms. Pyridazine is a six-membered aromatic ring with two adjacent nitrogen atoms, and for carbon atoms.

External Descriptors

Not available

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