Structure Information
Structure

Compound Identification

SMILES

NC1=C(F)C=NC(=O)N1.OC(CN1C=NC=N1)(CN1C=NC=N1)C1=C(F)C=C(F)C=C1

InChIKey

InChIKey=BTCCYWBZVBMIGR-UHFFFAOYSA-N

Formula

C17H16F3N9O2

Mass

435.371

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

Halopyrimidines

Alternative Parents

Molecular Framework

Not available

Substituents

Aminopyrimidine - Fluorobenzene - Halobenzene - Halopyrimidine - Pyrimidone - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - Benzenoid - Tertiary alcohol - Heteroaromatic compound - 1,2,4-triazole - Azole - Azacycle - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Amine - Organooxygen compound - Aromatic alcohol - Alcohol - Primary amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as halopyrimidines. These are aromatic compounds containing a halogen atom linked to a pyrimidine ring. 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