Structure Information
Structure

Compound Identification

SMILES

CC1=CN2C(=O)C(C=C3SC(=S)N(CC4=CC=C(F)C=C4)C3=O)=C(SC3=CC=C(Cl)C=C3)N=C2C=C1

InChIKey

InChIKey=BTDHLLILSCTDSN-UHFFFAOYSA-N

Formula

C26H17ClFN3O2S3

Mass

554.07

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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

Pyridopyrimidines Thiophenol ethers Chlorobenzenes Fluorobenzenes Methylpyridines Pyrimidones Aryl fluorides Aryl chlorides Vinylogous thioesters Thiazolidinethiones Heteroaromatic compounds Cyclic dithiocarbamic acid esters Lactams Azacyclic compounds Carboxylic acids and derivatives Sulfenyl compounds Organonitrogen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Diarylthioether - Pyridopyrimidine - Thiophenol ether - Chlorobenzene - Fluorobenzene - Halobenzene - Methylpyridine - Pyrimidone - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyridine - Pyrimidine - Thiazolidinethione - Benzenoid - Vinylogous thioester - Cyclic dithiocarbamic acid ester - Dithiocarbamic acid ester - Heteroaromatic compound - Thiazolidine - Lactam - Organoheterocyclic compound - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - 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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