Compound Identification
SMILES
FC1=CC=C(NC2=NC=C3CN(CC4=CC=C(Br)S4)CCC3=N2)C=C1
InChIKey
InChIKey=UJBBRPXWNGTKTF-UHFFFAOYSA-N
Formula
C18H16BrFN4S
Mass
419.32
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyridopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyridopyrimidines
Alternative Parents
Aniline and substituted anilines Fluorobenzenes Aralkylamines Aminopyrimidines and derivatives 2,5-disubstituted thiophenes Pyridines and derivatives Aryl fluorides Aryl bromides Heteroaromatic compounds Trialkylamines Secondary amines Azacyclic compounds Organofluorides Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridopyrimidine - Aniline or substituted anilines - Aminopyrimidine - Fluorobenzene - Halobenzene - 2,5-disubstituted thiophene - Aralkylamine - Aryl fluoride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Pyridine - Pyrimidine - Aryl bromide - Thiophene - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Azacycle - Secondary amine - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyridopyrimidines. These are compounds containing a pyridopyrimidine, which consists of a pyridine fused to a pyrimidine. Pyridine is 6-membered ring consisting of five carbon atoms and a nitrogen atom. 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