Structure Information
Structure

Compound Identification

SMILES

C[C@H]1CN(Cc2c(C)[nH]c(\C=C3/C(=O)Nc4ccc(cc34)[S@@](=O)Cc3ccccc3)c2C)C[C@@H](C)N1

InChIKey

InChIKey=KGVIPVJNRCHNOA-UHELABPCSA-N

Formula

C29H34N4O2S

Mass

502.68

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 sulfoxides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzyl sulfoxide - Indole or derivatives - Dihydroindole - Aralkylamine - N-alkylpiperazine - Substituted pyrrole - 1,4-diazinane - Piperazine - Pyrrole - Heteroaromatic compound - Lactam - Tertiary aliphatic amine - Tertiary amine - Sulfoxide - Carboxamide group - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Organoheterocyclic compound - Sulfinyl compound - Secondary amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound

Description

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

External Descriptors

Not available

Previous Back Next