Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(NC(=O)CSC2=NN=C(CNC(=O)C3=CC=C(C=C3)[N+]([O-])=O)N2C2=CC=C(F)C=C2)SC2=C1CCC2

InChIKey

InChIKey=JQMCKXDEKPCPKC-UHFFFAOYSA-N

Formula

C28H25FN6O6S2

Mass

624.66

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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 heteropolycyclic compounds

Substituents

Phenyl-1,2,4-triazole - Benzamide - Benzoic acid or derivatives - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Benzoyl - Thiophene carboxylic acid or derivatives - N-arylamide - Fluorobenzene - Halobenzene - Alkylarylthioether - Aryl halide - Monocyclic benzene moiety - Benzenoid - Aryl fluoride - Vinylogous amide - Heteroaromatic compound - Thiophene - Carboxamide group - Carboxylic acid ester - C-nitro compound - Secondary carboxylic acid amide - Organic nitro compound - Sulfenyl compound - Azacycle - Allyl-type 1,3-dipolar organic compound - Thioether - Organic oxoazanium - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Organosulfur compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic 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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