Structure Information
Structure

Compound Identification

SMILES

NC1=NC=NC2=C1N=C(SC1=C(Cl)C=CC(=C1)C(F)(F)F)N2CCCC#C

InChIKey

InChIKey=JXFUFYZAMILNRB-UHFFFAOYSA-N

Formula

C17H13ClF3N5S

Mass

411.83

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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

Trifluoromethylbenzenes 6-aminopurines Thiophenol ethers Aminopyrimidines and derivatives Chlorobenzenes Aryl chlorides Imidolactams N-substituted imidazoles Heteroaromatic compounds Acetylides Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Organopnictogen compounds Primary amines Alkyl fluorides Organochlorides Organofluorides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Diarylthioether - 6-aminopurine - Trifluoromethylbenzene - Imidazopyrimidine - Purine - Thiophenol ether - Aminopyrimidine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyrimidine - N-substituted imidazole - Azole - Heteroaromatic compound - Imidazole - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Acetylide - Organohalogen compound - Primary amine - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Amine - Organochloride - Organofluoride - Organonitrogen 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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