Structure Information
Structure

Compound Identification

SMILES

CN1C(=O)N(C)C2=C(C1=O)C(SCC[NH+]1CCCCC1)=NC(=N2)C1=CC=C(C)C=C1

InChIKey

InChIKey=IDYRIYLTRFEWQT-UHFFFAOYSA-O

Formula

C22H28N5O2S

Mass

426.56

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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

Alkylarylthioethers Pyrimidones Toluenes Vinylogous thioesters Piperidines Quaternary ammonium salts Vinylogous amides Heteroaromatic compounds Lactams Ureas Trialkylamines Sulfenyl compounds Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives Organic cations

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aryl thioether - Pyrimidone - Alkylarylthioether - Toluene - Monocyclic benzene moiety - Piperidine - Pyrimidine - Vinylogous thioester - Benzenoid - Heteroaromatic compound - Quaternary ammonium salt - Vinylogous amide - Lactam - Tertiary amine - Urea - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic 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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