Structure Information
Structure

Compound Identification

SMILES

Cl.O=C(NCCN1CCNCC1)N1C2=CC=CC=C2SC2=C1N=CC=C2

InChIKey

InChIKey=NPMLYZOSMYWZQV-UHFFFAOYSA-N

Formula

C18H22ClN5OS

Mass

391.92

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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

Benzothiazines N-alkylpiperazines Pyridines and derivatives Imidolactams Benzenoids 1,4-thiazines Heteroaromatic compounds Ureas Trialkylamines Dialkylamines Azacyclic compounds Organic oxides Hydrochlorides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Diarylthioether - Benzothiazine - N-alkylpiperazine - Para-thiazine - 1,4-diazinane - Piperazine - Pyridine - Benzenoid - Imidolactam - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Urea - Secondary amine - Azacycle - Secondary aliphatic amine - Organoheterocyclic compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Carbonyl group - Organic oxygen compound - Hydrochloride - 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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