Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C(SCC(=O)N2CCCN(CC3=CC=NC=C3)CC2)C=C1

InChIKey

InChIKey=XCRBTVDFUAJGEQ-UHFFFAOYSA-N

Formula

C21H27N3O3S

Mass

401.53

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Methoxybenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Dimethoxybenzenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

O-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Aryl thioether - Anisole - Phenol ether - Thiophenol ether - 1,4-diazepane - Alkyl aryl ether - Diazepane - Aralkylamine - Alkylarylthioether - Pyridine - Heteroaromatic compound - Tertiary carboxylic acid amide - Tertiary aliphatic amine - Amino acid or derivatives - Carboxamide group - Tertiary amine - Sulfenyl compound - Organoheterocyclic compound - Thioether - Carboxylic acid derivative - Ether - Azacycle - Hydrocarbon derivative - Amine - Organic oxygen compound - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups.

External Descriptors

Not available

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