Compound Identification
SMILES
CC(=O)NC1=C(C(=O)OCC2=CC(=O)[N+]3=C(N2)C=CC(Br)=C3)C2=C(CCCC2)S1
InChIKey
InChIKey=LDNLFDWKQOQGMJ-UHFFFAOYSA-O
Formula
C20H19BrN3O4S
Mass
477.35
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
N-acetylarylamines Thiophene carboxylic acids and derivatives Pyrimidones Aryl bromides Pyridinium derivatives Vinylogous amides Heteroaromatic compounds Acetamides Lactams Carboxylic acid esters Secondary carboxylic acid amides Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridopyrimidine - N-acetylarylamine - Thiophene carboxylic acid or derivatives - N-arylamide - Pyrimidone - Aryl bromide - Aryl halide - Pyridine - Pyridinium - Pyrimidine - Heteroaromatic compound - Acetamide - Vinylogous amide - Thiophene - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactam - Azacycle - Carboxylic acid derivative - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic cation - 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