Structure Information
Structure

Compound Identification

SMILES

OC(=O)CSC1=C(NC2=NC=C(C=C2)[N+]([O-])=O)C=CC=N1

InChIKey

InChIKey=SIMQAUFSBNNHDE-UHFFFAOYSA-N

Formula

C12H10N4O4S

Mass

306.3

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organosulfur compounds

Class

Thioethers

Subclass

Aryl thioethers

Intermediate Tree Nodes

Not available

Direct Parent

Aryl thioethers

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aryl thioether - Nitroaromatic compound - Aminopyridine - Alkylarylthioether - Pyridine - Imidolactam - Heteroaromatic compound - Amino acid or derivatives - C-nitro compound - Organic nitro compound - Amino acid - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxoazanium - Secondary amine - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic zwitterion - Organic nitrogen compound - Amine - Carbonyl group - Organopnictogen compound - Organic oxide - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group.

External Descriptors

Not available

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