Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(C=C1)N1C(CNC(=O)C2=CC(=C(C)C=C2)[N+]([O-])=O)=NN=C1SCC1=CC=CC=C1

InChIKey

InChIKey=IKARECSMOJLMPO-UHFFFAOYSA-N

Formula

C25H23N5O3S

Mass

473.55

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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 - Benzamide - Nitrobenzene - Nitrotoluene - Toluamide - P-toluamide - Benzoic acid or derivatives - Benzoyl - Nitroaromatic compound - Aryl thioether - Toluene - Alkylarylthioether - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Carboxamide group - Organic nitro compound - C-nitro compound - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Thioether - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Organic salt - 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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