Structure Information
Structure

Compound Identification

SMILES

OP(=O)(OC1=C(Br)C=C(CCCSC2=NNC(=N2)C2=CC=C(Cl)C=C2)C=C1)C(F)F

InChIKey

InChIKey=ICMUBCQCECPSGO-UHFFFAOYSA-N

Formula

C18H16BrClF2N3O3PS

Mass

538.73

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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 - Phenoxy compound - Aryl thioether - Bromobenzene - Chlorobenzene - Halobenzene - Alkylarylthioether - Aryl bromide - Benzenoid - Phosphonic acid ester - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Organophosphonic acid - Organophosphonic acid derivative - Azacycle - Sulfenyl compound - Thioether - Organic oxygen compound - Organochloride - Organobromide - Organofluoride - Organonitrogen compound - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organooxygen compound - Organophosphorus compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - 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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