Structure Information
Structure

Compound Identification

SMILES

[Cl-].CSC1=C(NCC2=NCC[NH2+]2)C=C(C)C=C1

InChIKey

InChIKey=BXXCVDWYOYXSDI-UHFFFAOYSA-N

Formula

C12H18ClN3S

Mass

271.81

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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

Thiophenol ethers Aminotoluenes Phenylalkylamines Aniline and substituted anilines Alkylarylthioethers Secondary alkylarylamines Quaternary ammonium salts Imidazolines Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboximidamides Carboxamidines Organic zwitterions Hydrocarbon derivatives Organic chloride salts

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aryl thioether - Aminotoluene - Thiophenol ether - Phenylalkylamine - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Toluene - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - 2-imidazoline - Quaternary ammonium salt - Organic 1,3-dipolar compound - Carboxylic acid amidine - Amidine - Secondary amine - Azacycle - Carboximidamide - Sulfenyl compound - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organic salt - Organic chloride salt - Organonitrogen compound - Organic zwitterion - Amine - Hydrocarbon derivative - 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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