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Structure Information
Structure

Compound Identification

SMILES

CC1=C(C=CC(=O)NC(CO)CS(=O)CC2=CC=CC=C2)C(=O)NC(=O)N1

InChIKey

InChIKey=YLMGINPOMBXUKT-UHFFFAOYSA-N

Formula

C18H21N3O5S

Mass

391.44

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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 - Pyrimidone - Hydropyrimidine - Pyrimidine - Vinylogous amide - Heteroaromatic compound - Carboxamide group - Lactam - Secondary carboxylic acid amide - Sulfoxide - Urea - Carboxylic acid derivative - Sulfinyl compound - Organoheterocyclic compound - Azacycle - Alcohol - Carbonyl group - Organic oxide - Organic oxygen compound - Primary alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - 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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