Compound Identification
SMILES
CN1C(=O)N(C)C2=C(C(C3=CC=C(Cl)C=C3)\C(=C3\NC4=CC=CC=C4S3)C(=N2)C2=CC=CC=C2)C1=O
InChIKey
InChIKey=VQWIGTCUFXBNCJ-XTCLZLMSSA-N
Formula
C28H21ClN4O2S
Mass
513.01
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
Benzothiazoles Aryl thioethers Pyrimidones Chlorobenzenes Aryl chlorides Pyridines and derivatives Vinylogous amides Thiazoles Heteroaromatic compounds Ureas Lactams Ketene acetals Ketimines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxides Organochlorides Amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridopyrimidine - Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Halobenzene - Pyrimidone - Chlorobenzene - Aryl chloride - Pyridine - Aryl halide - Pyrimidine - Monocyclic benzene moiety - Benzenoid - Thiazole - Heteroaromatic compound - Vinylogous amide - Lactam - Ketimine - Urea - Ketene acetal or derivatives - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Imine - Organooxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organochloride - Organohalogen 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