Structure Information
Structure

Compound Identification

SMILES

CC1=NN=C(SCC2=NC(=NO2)C2=CC=C(Cl)C=C2)N1C1=CC(C)=C(C)C=C1

InChIKey

InChIKey=AJMJABBPMSQDAI-UHFFFAOYSA-N

Formula

C20H18ClN5OS

Mass

411.91

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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

Phenyltriazole - Phenyl-1,2,4-triazole - Phenyl-1,2,4-oxadiazole - Aryl thioether - Xylene - O-xylene - Halobenzene - Alkylarylthioether - Chlorobenzene - Monocyclic benzene moiety - Benzenoid - Aryl chloride - Aryl halide - 1,2,4-triazole - Heteroaromatic compound - Triazole - Oxacycle - Azacycle - Thioether - Sulfenyl compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organosulfur compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - 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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