Compound Identification
SMILES
COC1=CC=C(CCN2C(=S)SC(=CC3=C(N=C4C=CC=CN4C3=O)N3CCCC3)C2=O)C=C1
InChIKey
InChIKey=XWEKJOZYUDRDAT-UHFFFAOYSA-N
Formula
C25H24N4O3S2
Mass
492.61
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
Anisoles Dialkylarylamines Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Aminopyrimidines and derivatives Pyrimidones Thiazolidinethiones Pyridines and derivatives Imidolactams Pyrrolidines Heteroaromatic compounds Vinylogous amides Cyclic dithiocarbamic acid esters Lactams Carboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organosulfur compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridopyrimidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Dialkylarylamine - Alkyl aryl ether - Aminopyrimidine - Pyrimidone - Monocyclic benzene moiety - Pyridine - Pyrimidine - Imidolactam - Benzenoid - Thiazolidinethione - Cyclic dithiocarbamic acid ester - Heteroaromatic compound - Dithiocarbamic acid ester - Vinylogous amide - Pyrrolidine - Thiazolidine - Lactam - Ether - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Organic nitrogen compound - Organic oxygen compound - 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