Structure Information
Structure

Compound Identification

SMILES

BrC1=CC=C(C=C1)C1=NN=C2SC3=C(C=C(C#N)C(=C3)C#N)N12

InChIKey

InChIKey=XQLOWHJGAYNTNE-UHFFFAOYSA-N

Formula

C16H6BrN5S

Mass

380.22

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzotriazoles

Subclass

Triazolobenzothiazoles

Intermediate Tree Nodes

Not available

Direct Parent

Triazolobenzothiazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Triazolobenzothiazole - Phenyltriazole - Phenyl-1,2,4-triazole - 1,3-benzothiazole - Triazolothiazole - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Triazole - Thiazole - 1,2,4-triazole - Heteroaromatic compound - Azole - Nitrile - Carbonitrile - Azacycle - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Cyanide - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as triazolobenzothiazoles. These are compound containing a triazole ring fused to the benzene or the thiazole moiety of the benzothiazole ring system.

External Descriptors

Not available

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