Structure Information
Structure

Compound Identification

SMILES

CSC1=C(C=CC(CN2CCCN(CC3=NOC(=N3)C3=CC=CC=C3)CC2)=N1)C#N

InChIKey

InChIKey=OWOUNFHWNZCDJS-UHFFFAOYSA-N

Formula

C22H24N6OS

Mass

420.54

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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 heteromonocyclic compounds

Substituents

Phenyl-1,2,4-oxadiazole - 6-substituted-2-pyridinylmethylamine - 2-pyridylmethylamine - Aryl thioether - 3-pyridinecarbonitrile - 1,4-diazepane - Diazepane - Aralkylamine - Alkylarylthioether - Monocyclic benzene moiety - Pyridine - Benzenoid - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Sulfenyl compound - Azacycle - Thioether - Oxacycle - Carbonitrile - Nitrile - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Cyanide - Organic oxygen compound - Amine - Aromatic heteromonocyclic 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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