Structure Information
Structure

Compound Identification

SMILES

CN1N=CC2=C1N=CN=C2SC1=CC=C(Cl)C=C1

InChIKey

InChIKey=DWNXJJMPMJYMAB-UHFFFAOYSA-N

Formula

C12H9ClN4S

Mass

276.74

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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

Pyrazolo[3,4-d]pyrimidines Thiophenol ethers Chlorobenzenes Pyrimidines and pyrimidine derivatives Aryl chlorides Pyrazoles Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Diarylthioether - Pyrazolo[3,4-d]pyrimidine - Pyrazolopyrimidine - Thiophenol ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Azole - Pyrazole - Heteroaromatic compound - Sulfenyl compound - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Organopnictogen compound - Organic nitrogen compound - 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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