Structure Information
Structure

Compound Identification

SMILES

CC(NC(=O)C1=CC(=C(C)C=C1)[N+]([O-])=O)C1=NN=C(SCC2=CC=CC=C2C)N1C1=C(C)C=CC(Cl)=C1

InChIKey

InChIKey=UKZOGWQUELQDNO-UHFFFAOYSA-N

Formula

C27H26ClN5O3S

Mass

536.05

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