Compound Identification
SMILES
COC1=C(Cl)C=C(C=N1)N1CCC2=C(C1)C(NC1CCN(C1)C(=O)OC(C)(C)C)=NC=N2
InChIKey
InChIKey=FDSILRSPUBDOJK-UHFFFAOYSA-N
Formula
C22H29ClN6O3
Mass
460.96
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
Pyrrolidine carboxylic acids Dialkylarylamines Aralkylamines Aminopyrimidines and derivatives Aminopyridines and derivatives Alkyl aryl ethers Imidolactams Aryl chlorides Heteroaromatic compounds Carbamate esters Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridopyrimidine - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Alkyl aryl ether - Aminopyridine - Aminopyrimidine - Aralkylamine - Aryl chloride - Aryl halide - Pyridine - Pyrimidine - Imidolactam - Heteroaromatic compound - Carbamic acid ester - Pyrrolidine - Tertiary amine - Azacycle - Ether - Organochloride - Organohalogen compound - Hydrocarbon derivative - Carbonyl group - Amine - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen 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