Compound Identification
SMILES
FC1=CC=CC=C1CSC1=NC(=O)C2=C(NC3=C(C2C2=CC4=C(OCO4)C=C2)C(=O)CCC3)N1
InChIKey
InChIKey=KXORXYLSWBMZRH-UHFFFAOYSA-N
Formula
C25H20FN3O4S
Mass
477.51
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
Benzodioxoles Alkylarylthioethers Pyrimidones Cyclohexenones Fluorobenzenes Pyridines and derivatives Aryl fluorides Vinylogous amides Heteroaromatic compounds Acetals Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Enamines Organopnictogen compounds Organofluorides Aldehydes Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridopyrimidine - Benzodioxole - Aryl thioether - Fluorobenzene - Halobenzene - Pyrimidone - Alkylarylthioether - Cyclohexenone - Aryl fluoride - Benzenoid - Aryl halide - Pyrimidine - Pyridine - Monocyclic benzene moiety - Vinylogous amide - Heteroaromatic compound - Ketone - Oxacycle - Azacycle - Sulfenyl compound - Thioether - Enamine - Acetal - Organopnictogen compound - Organohalogen compound - Organofluoride - Aldehyde - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - 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