Structure Information
Structure

Compound Identification

SMILES

CN1C=NN=C1SC1=NC(C(=O)NC2=NC=CS2)=C(SC2=CC=C(F)C=C2)C=C1

InChIKey

InChIKey=YIYCQXYPCZMPSG-UHFFFAOYSA-N

Formula

C18H13FN6OS3

Mass

444.52

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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

Pyridinecarboxamides Thiophenol ethers 2-heteroaryl carboxamides Fluorobenzenes Vinylogous thioesters Aryl fluorides Triazoles Thiazoles Heteroaromatic compounds Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Organofluorides Organonitrogen compounds Organooxygen compounds Hydrocarbon derivatives Organic oxides

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Diarylthioether - Pyridinecarboxamide - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - Thiophenol ether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Vinylogous thioester - 1,2,4-triazole - Thiazole - Azole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteromonocyclic 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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