Structure Information
Structure

Compound Identification

SMILES

FC1=CC=C(C=C1)C1=CSC2=NC3=C(C=NN3)C(=S)N12

InChIKey

InChIKey=KOTHELHSWVHJIB-UHFFFAOYSA-N

Formula

C13H7FN4S2

Mass

302.35

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Imidazopyrimidines

Subclass

Purines and purine derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Dithioxanthines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dithioxanthine - Pyrazolo[3,4-d]pyrimidine - Pyrazolopyrimidine - Fluorobenzene - Halobenzene - Pyrimidinethione - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Pyrazole - Heteroaromatic compound - Azole - Thiazole - Thiolactam - Azacycle - Organosulfur compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dithioxanthines. These are compounds containing a dithioxanthine moiety, a xanthine derivative obtained by replacing the two ketone groups by two thioketone groups.

External Descriptors

Not available

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