Structure Information
Structure

Compound Identification

SMILES

CC(N)=C(C#N)C(=O)CSC1=NN=C(N1N)C(F)(F)F

InChIKey

InChIKey=NIXSMKOCNYRCRE-UHFFFAOYSA-N

Formula

C9H9F3N6OS

Mass

306.27

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organosulfur compounds

Class

Thioethers

Subclass

Aryl thioethers

Intermediate Tree Nodes

Not available

Direct Parent

Aryl thioethers

Alternative Parents

Alkylarylthioethers Alpha-branched alpha,beta-unsaturated ketones Vinylogous amides Triazoles Acryloyl compounds Heteroaromatic compounds Enones Ketones Sulfenyl compounds Nitriles Azacyclic compounds Enamines Hydrocarbon derivatives Monoalkylamines Organic oxides Alkyl fluorides Organofluorides

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aryl thioether - Alkylarylthioether - Alpha-branched alpha,beta-unsaturated-ketone - Acryloyl-group - Azole - Enone - 1,2,4-triazole - Heteroaromatic compound - Alpha,beta-unsaturated ketone - Vinylogous amide - Ketone - Enamine - Carbonitrile - Nitrile - Sulfenyl compound - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Primary aliphatic amine - Organic oxide - Cyanide - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Primary amine - Hydrocarbon derivative - Amine - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group.

External Descriptors

Not available

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