Structure Information
Structure

Compound Identification

SMILES

Cl.CC1=C(C=C(C=C1)C(O)CO)C1=NN=C2C=CC(SC3=C(F)C=C(F)C=C3)=CN12

InChIKey

InChIKey=SBRBAUPWVMRUNR-UHFFFAOYSA-N

Formula

C21H18ClF2N3O2S

Mass

449.9

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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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenyltriazole - Phenyl-1,2,4-triazole - Diarylthioether - Triazolopyridine - Thiophenol ether - Fluorobenzene - Halobenzene - Toluene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Azole - Heteroaromatic compound - 1,2,4-triazole - Triazole - 1,2-diol - Secondary alcohol - Azacycle - Sulfenyl compound - Organoheterocyclic compound - Alcohol - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic alcohol - Hydrochloride - Hydrocarbon derivative - 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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