Structure Information
Structure

Compound Identification

SMILES

OC(CSC1=C(C#N)C(=CC(=N1)C1=CC=CS1)C(F)(F)F)CS(=O)CC1=CC=CC=C1

InChIKey

InChIKey=WTDHSKFUWXVDGD-UHFFFAOYSA-N

Formula

C21H17F3N2O2S3

Mass

482.55

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzyl sulfoxides

Intermediate Tree Nodes

Not available

Direct Parent

Benzyl alkyl sulfoxides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzyl alkyl sulfoxide - Aryl thioether - 3-pyridinecarbonitrile - Alkylarylthioether - Pyridine - Thiophene - Heteroaromatic compound - Secondary alcohol - Sulfoxide - Carbonitrile - Nitrile - Azacycle - Thioether - Sulfinyl compound - Sulfenyl compound - Organoheterocyclic compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Alcohol - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Cyanide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzyl alkyl sulfoxides. These are organosulfur compounds that contain a sulfoxide group substituted by a benzyl group, and an alkyl group. They have the general structure RS(=O)R' ( R=benzyl, R'=alkyl).

External Descriptors

Not available

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