Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(NC(=O)CSC2=NN=C(N2CC=C)C2=CC=C(C=C2)N(C)C)SC=C1C1=CC=C(F)C=C1

InChIKey

InChIKey=QADRMBFFAFABFX-UHFFFAOYSA-N

Formula

C27H26FN5O3S2

Mass

551.66

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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 heteromonocyclic compounds

Substituents

Phenyl-1,2,4-triazole - Thiophene carboxylic acid or derivatives - Tertiary aliphatic/aromatic amine - N-arylamide - Dialkylarylamine - Aniline or substituted anilines - Aryl thioether - Alkylarylthioether - Halobenzene - Fluorobenzene - Aryl fluoride - Benzenoid - Monocyclic benzene moiety - Aryl halide - Thiophene - Vinylogous amide - Heteroaromatic compound - Methyl ester - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Tertiary amine - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Thioether - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Amine - Carbonyl group - Organic oxide - Organosulfur compound - Organic nitrogen compound - Organic oxygen 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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