Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=CN=C(S\C=C/C(=O)C2=CC=C(F)C=C2)N=C1N

InChIKey

InChIKey=KEHFJAJVWGTKSO-FPLPWBNLSA-N

Formula

C16H14FN3O3S

Mass

347.36

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

Pyrimidinecarboxylic acids and derivatives

Direct Parent

Pyrimidinecarboxylic acids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Pyrimidine-5-carboxylic acid - Aryl thioether - Benzoyl - Aryl ketone - Halobenzene - Fluorobenzene - Aminopyrimidine - Aryl fluoride - Aryl halide - Vinylogous thioester - Imidolactam - Monocyclic benzene moiety - Benzenoid - Acryloyl-group - Enone - Heteroaromatic compound - Vinylogous amide - Alpha,beta-unsaturated ketone - Amino acid or derivatives - Ketone - Thioenolether - Carboxylic acid ester - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Primary amine - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidinecarboxylic acids. These are pyrimidines with a structure containing a carboxyl group attached to the pyrimidine ring.

External Descriptors

Not available

Previous Back Next