Structure Information
Structure

Compound Identification

SMILES

OS(O)(=O)=O.NC1=NC2=C(S1)C=C(C=C2)[N+]([O-])=O.NC1=NC2=C(S1)C=C(C=C2)[N+]([O-])=O

InChIKey

InChIKey=JAXPBVSIJFQLJK-UHFFFAOYSA-N

Formula

C14H12N6O8S3

Mass

488.46

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiazoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzothiazoles

Alternative Parents

Molecular Framework

Not available

Substituents

1,3-benzothiazole - Nitroaromatic compound - Sulfuric acid - 1,3-thiazol-2-amine - Benzenoid - Azole - Heteroaromatic compound - Organic sulfuric acid or derivatives - Thiazole - C-nitro compound - Organic nitro compound - Organic oxoazanium - Azacycle - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Primary amine - Organonitrogen compound - Hydrocarbon derivative - Amine - Organic salt - Organic zwitterion - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).

External Descriptors

Not available

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