Compound Identification
SMILES
CC1CCC(\C=N\c2ccc(cc2)C(F)(F)F)=C2NC=C(C(O)=O)C(=O)N12
InChIKey
InChIKey=BMVDCEBYLUAMQR-GZIVZEMBSA-N
Formula
C18H16F3N3O3
Mass
379.339
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
Trifluoromethylbenzenes Tetrahydropyridines Hydropyrimidines Vinylogous amides Tertiary carboxylic acid amides Shiff bases Ketene acetals Lactams Azacyclic compounds Carboxylic acids Enamines Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Alkyl fluorides Organofluorides Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - Pyridopyrimidine - Tetrahydropyridine - Monocyclic benzene moiety - Hydropyrimidine - 1,2,3,4-tetrahydropyrimidine - Benzenoid - Vinylogous amide - Tertiary carboxylic acid amide - Carboxamide group - Ketene acetal or derivatives - Lactam - Shiff base - Aldimine - Carboxylic acid derivative - Carboxylic acid - Enamine - Azacycle - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Propargyl-type 1,3-dipolar organic compound - Imine - Hydrocarbon derivative - Organic oxide - Amine - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - 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