Structure Information
Structure

Compound Identification

SMILES

[Zn++].CC(C)C1=NC(=NC(C2=CC=C(F)C=C2)=C1\C=C\C(O)CC(O)CC([O-])=O)N(C)S(C)(=O)=O

InChIKey

InChIKey=AUPPJPPIQVIVIK-RRABGKBLSA-M

Formula

C22H27FN3O6SZn

Mass

545.91

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazines

Subclass

Pyrimidines and pyrimidine derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrimidines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

4-phenylpyrimidine - Medium-chain hydroxy acid - Medium-chain fatty acid - Hydroxy fatty acid - Halobenzene - Fluorobenzene - Beta-hydroxy acid - Hydroxy acid - Fatty acyl - Fatty acid - Organosulfonic acid amide - Benzenoid - Aryl halide - Unsaturated fatty acid - Monocyclic benzene moiety - Aryl fluoride - Organic sulfonic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Aminosulfonyl compound - Organic sulfonic acid or derivatives - Heteroaromatic compound - Carboxylic acid salt - Secondary alcohol - Organic metal halide - Carboxylic acid derivative - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Organic transition metal salt - Organosulfur compound - Organic nitrogen compound - Organic salt - Organohalogen compound - Hydrocarbon derivative - Organofluoride - Alcohol - Organonitrogen compound - Carbonyl group - Organic oxide - Organooxygen compound - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrimidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrimidine ring through a CC or CN bond. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.

External Descriptors

Not available

Previous Back Next