Structure Information
Structure

Compound Identification

SMILES

CCN1C(=O)C(SC1=NC1=CC(C)=C(C)C=C1)=CC1=CC(Br)=C(OC)C=C1

InChIKey

InChIKey=WQVAFROCZAAHDK-UHFFFAOYSA-N

Formula

C21H21BrN2O2S

Mass

445.38

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenol ethers

Subclass

Anisoles

Intermediate Tree Nodes

Not available

Direct Parent

Anisoles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Methoxybenzene - Phenoxy compound - Anisole - Xylene - O-xylene - Halobenzene - Bromobenzene - Alkyl aryl ether - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Thiazolidine - Isothiourea - Ether - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organohalogen compound - Organobromide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.

External Descriptors

Not available

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