Structure Information
Structure

Compound Identification

SMILES

CC1=CC=CC(C)=C1NCC1=NN=C(SCC(=O)NC2=CC(=C(C)C=C2)[N+]([O-])=O)N1C1=CC=CC=C1

InChIKey

InChIKey=SMPICFFSEPANDW-UHFFFAOYSA-N

Formula

C26H26N6O3S

Mass

502.59

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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 - Nitrobenzene - Anilide - Nitrotoluene - Aniline or substituted anilines - Aryl thioether - Nitroaromatic compound - Phenylalkylamine - M-xylene - Xylene - N-arylamide - Alkylarylthioether - Aralkylamine - Secondary aliphatic/aromatic amine - Toluene - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - C-nitro compound - Secondary carboxylic acid amide - Organic nitro compound - Organic 1,3-dipolar compound - Azacycle - Sulfenyl compound - Propargyl-type 1,3-dipolar organic compound - Thioether - Allyl-type 1,3-dipolar organic compound - Secondary amine - Carboxylic acid derivative - Organic oxoazanium - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - Amine - Organic zwitterion - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - 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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