Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C(C=C1)C1=NOC(CN(C)CC2=NC3=CC=CC=C3S2)=N1

InChIKey

InChIKey=WNDVBBJNYZCLJI-UHFFFAOYSA-N

Formula

C20H20N4O3S

Mass

396.47

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Oxadiazoles

Intermediate Tree Nodes

1,2,4-oxadiazoles

Direct Parent

Phenyloxadiazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenyl-1,2,4-oxadiazole - O-dimethoxybenzene - Dimethoxybenzene - 1,3-benzothiazole - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Thiazole - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Ether - Azacycle - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenyloxadiazoles. These are polycyclic aromatic compounds containing a benzene ring linked to a 1,2,4-oxadiazole ring through a CC or CN bond.

External Descriptors

Not available

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