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Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(OCC2=NN=C(SCC3=NOC(=C3)C3=CC=CC=C3)N2C)C=C1

InChIKey

InChIKey=PCLNPKJGRKYMGI-UHFFFAOYSA-N

Formula

C21H20N4O3S

Mass

408.48

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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

Phenoxy compound - Aryl thioether - Anisole - Methoxybenzene - Alkyl aryl ether - Alkylarylthioether - Monocyclic benzene moiety - Azole - Isoxazole - 1,2,4-triazole - Heteroaromatic compound - Sulfenyl compound - Thioether - Ether - Organoheterocyclic compound - Oxacycle - Azacycle - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen 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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