Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC2CCCC2)C=C(NC(=O)N2CCCN(CC3=NOC(=N3)C3=CC=CC=C3)CC2)C=C1

InChIKey

InChIKey=NROXTVMLLVIJAS-UHFFFAOYSA-N

Formula

C27H33N5O4

Mass

491.592

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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 - N-phenylurea - Methoxyaniline - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - 1,4-diazepane - Alkyl aryl ether - Diazepane - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Urea - Tertiary amine - Tertiary aliphatic amine - Azacycle - Ether - Oxacycle - Organooxygen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - 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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