Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(NC2=NN=C(SC3=C(N=CN3C)[N+]([O-])=O)S2)C=C1

InChIKey

InChIKey=BKXOMUQUAPHBCG-UHFFFAOYSA-N

Formula

C13H12N6O3S2

Mass

364.4

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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

Diarylthioethers

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Diarylthioether - Methoxyaniline - Phenoxy compound - Nitroaromatic compound - Anisole - Nitroimidazole - Phenol ether - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - 2-amino-5-substituted-1,3,4-thiadiazole - 2-amino-1,3,4-thiadiazole - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Imidolactam - Heteroaromatic compound - Azole - Imidazole - Thiadiazole - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Azacycle - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Ether - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Secondary amine - Sulfenyl compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic salt - Organic zwitterion - Aromatic heteromonocyclic compound

Description

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

External Descriptors

Not available

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