Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(CNC2=C(C(SC3=CC=CC=C3)=NC=N2)[N+]([O-])=O)C=C1

InChIKey

InChIKey=KVBIOKYFPBRYDZ-UHFFFAOYSA-N

Formula

C18H16N4O3S

Mass

368.41

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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

Thiophenol ethers Phenoxy compounds Anisoles Benzylamines Nitroaromatic compounds Methoxybenzenes Alkyl aryl ethers Aminopyrimidines and derivatives Imidolactams Heteroaromatic compounds Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Amines Organic salts Organic zwitterions Hydrocarbon derivatives Organic oxides

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Diarylthioether - Phenoxy compound - Nitroaromatic compound - Anisole - Benzylamine - Phenol ether - Thiophenol ether - Methoxybenzene - Alkyl aryl ether - Aminopyrimidine - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Imidolactam - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Sulfenyl compound - Azacycle - Ether - Organic oxoazanium - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic zwitterion - Organic salt - Organic oxide - 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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