Compound Identification
SMILES
NC1=NC(=O)C2=C(NCC(CCC3=CC=C(S3)C(=O)N3[C@H](C[C@H]3C(O)=O)C(O)=O)C2)N1
InChIKey
InChIKey=FKLDVRVHQMDEMA-FOGGPMGISA-N
Formula
C19H21N5O6S
Mass
447.47
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
Alpha amino acids and derivatives Thiophene carboxamides 2-heteroaryl carboxamides 2,5-disubstituted thiophenes Pyrimidones Aminopyrimidines and derivatives Azetidinecarboxylic acids Pyridines and derivatives Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Vinylogous amides Heteroaromatic compounds Amino acids Carboxylic acids Azacyclic compounds Carbonyl compounds Organic oxides Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Pyridopyrimidine - 2-heteroaryl carboxamide - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Aminopyrimidine - Azetidinecarboxylic acid - Pyrimidone - 2,5-disubstituted thiophene - Dicarboxylic acid or derivatives - Pyridine - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Tertiary carboxylic acid amide - Thiophene - Amino acid or derivatives - Azetidine - Carboxamide group - Amino acid - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Primary amine - Organic oxide - Hydrocarbon derivative - Amine - Organic nitrogen 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