Structure Information
Structure

Compound Identification

SMILES

COC1=CC(OC)=CC(NC(=O)NCC2=NN=C(SCC3=CC=CC=C3C)N2C2=CC=C(C=C2)[N+]([O-])=O)=C1

InChIKey

InChIKey=LTAOHZPCTODYPV-UHFFFAOYSA-N

Formula

C26H26N6O5S

Mass

534.59

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Triazoles

Intermediate Tree Nodes

Phenyltriazoles

Direct Parent

Phenyl-1,2,4-triazoles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenyl-1,2,4-triazole - Dimethoxybenzene - M-dimethoxybenzene - N-phenylurea - Methoxyaniline - Nitrobenzene - Nitroaromatic compound - Phenol ether - Methoxybenzene - Aryl thioether - Phenoxy compound - Anisole - Alkyl aryl ether - Toluene - Alkylarylthioether - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Urea - Organic 1,3-dipolar compound - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Thioether - Ether - Azacycle - Organic oxoazanium - Organic salt - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Organic zwitterion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenyl-1,2,4-triazoles. These are organic compounds containing a 1,2,4-triazole substituted by a phenyl group.

External Descriptors

Not available

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