Structure Information
Structure

Compound Identification

SMILES

CC(SC1=CC=C(C)C=C1)C(=O)N1CCN(CC2=CC3=C(OCO3)C=C2)CC1

InChIKey

InChIKey=ZSFVBRAWTMVMMX-UHFFFAOYSA-N

Formula

C22H26N2O3S

Mass

398.52

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzodioxoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzodioxoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzodioxole - Aryl thioether - Thiophenol ether - Aralkylamine - Alkylarylthioether - N-alkylpiperazine - Toluene - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Benzenoid - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Tertiary amine - Tertiary aliphatic amine - Acetal - Carboxylic acid derivative - Oxacycle - Azacycle - Sulfenyl compound - Thioether - Organonitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Carbonyl group - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.

External Descriptors

Not available

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