Structure Information
Structure

Compound Identification

SMILES

CC1=NC(SCS(=O)CC2=CC=CC=C2)=C(C#N)C(C)=C1

InChIKey

InChIKey=LYWUHWKZVHVJJK-UHFFFAOYSA-N

Formula

C16H16N2OS2

Mass

316.44

Export to:

JSON SDF CSV

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 - Methylpyridine - Pyridine - Heteroaromatic compound - Sulfoxide - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Thioether - Sulfenyl compound - Sulfinyl compound - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - 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

Previous Back Next