Structure Information
Structure

Compound Identification

SMILES

C[C@@H](O)CNC1=CC(SC2=NC3=CC=CC=C3N2)=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=XSLJHXLUHMFHLY-SNVBAGLBSA-N

Formula

C16H16N4O3S

Mass

344.39

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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 heteropolycyclic compounds

Substituents

Diarylthioether - Benzimidazole - Nitrobenzene - Nitroaromatic compound - Thiophenol ether - Aniline or substituted anilines - Phenylalkylamine - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azole - Imidazole - Organic nitro compound - C-nitro compound - Secondary alcohol - 1,2-aminoalcohol - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Sulfenyl compound - Secondary amine - Organic oxoazanium - Amine - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic zwitterion - Organic oxygen compound - Organic salt - Aromatic heteropolycyclic 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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