Compound Identification
SMILES
COC1=NC(=O)N2CCC3=C(C=CC(OS(=O)(=O)C(F)(F)F)=C3)C2=C1
InChIKey
InChIKey=FECAWYDGQDEOIR-UHFFFAOYSA-N
Formula
C14H11F3N2O5S
Mass
376.31
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
Trifluoromethanesulfonates Alkyl aryl ethers Pyrimidones Benzenoids Sulfonic acid esters Pyridines and derivatives Organosulfonic acid esters Sulfonyls Heteroaromatic compounds Methanesulfonates Trihalomethanes Azacyclic compounds Hydrocarbon derivatives Alkyl fluorides Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridopyrimidine - Trifluoromethanesulfonate - Alkyl aryl ether - Pyrimidone - Pyridine - Pyrimidine - Sulfonic acid ester - Organosulfonic acid ester - Benzenoid - Methanesulfonate - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Trihalomethane - Ether - Azacycle - Alkyl fluoride - Halomethane - Organic oxide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Alkyl halide - 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