Structure Information
Structure

Compound Identification

SMILES

COC1=CC(=CC(C)=C1OCC(O)CO)C1=NOC(=N1)C1=CC(C)=NC(NC(C)C)=N1

InChIKey

InChIKey=MVQCOCJABQAGMI-UHFFFAOYSA-N

Formula

C21H27N5O5

Mass

429.477

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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 - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Aminopyrimidine - Toluene - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Heteroaromatic compound - 1,2-diol - Secondary alcohol - Azacycle - Ether - Oxacycle - Secondary amine - Primary alcohol - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Organic nitrogen compound - Alcohol - 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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