Structure Information
Structure

Compound Identification

SMILES

COC1=CC(NC2=NC(N)=C(S2)C2=NC(=NO2)C2=C(C)C=CC(NC(=O)CC3=C(C)NC(=S)S3)=C2)=CC(OC)=C1OC

InChIKey

InChIKey=SURVMKUKRYUXNN-UHFFFAOYSA-N

Formula

C27H27N7O5S3

Mass

625.74

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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 - Anilide - Methoxyaniline - 2,4,5-trisubstituted 1,3-thiazole - Phenoxy compound - N-arylamide - Aniline or substituted anilines - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Toluene - Monocyclic benzene moiety - 1,3-thiazolamine - Imidolactam - Benzenoid - 1,3-thiazol-2-amine - Heteroaromatic compound - Thiazole - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Secondary amine - Azacycle - Oxacycle - Carboxylic acid derivative - Ether - Primary amine - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Amine - 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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