Compound Identification
SMILES
CC1=CN2C(=O)C(C=C3SC(=S)N(CC4=CC=CC=C4Cl)C3=O)=C(N=C2C=C1)N1CCC(CC1)C(N)=O
InChIKey
InChIKey=BXWLXKBJKBONBQ-UHFFFAOYSA-N
Formula
C26H24ClN5O3S2
Mass
554.08
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
Piperidinecarboxamides Dialkylarylamines Aminopyrimidines and derivatives Pyrimidones Chlorobenzenes Methylpyridines Thiazolidinethiones Aryl chlorides Imidolactams Vinylogous amides Cyclic dithiocarbamic acid esters Heteroaromatic compounds Primary carboxylic acid amides Lactams Azacyclic compounds Organochlorides Organosulfur compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridopyrimidine - Piperidinecarboxamide - Dialkylarylamine - Aminopyrimidine - Pyrimidone - Methylpyridine - Chlorobenzene - Halobenzene - Piperidine - Monocyclic benzene moiety - Pyridine - Imidolactam - Benzenoid - Thiazolidinethione - Aryl halide - Aryl chloride - Pyrimidine - Cyclic dithiocarbamic acid ester - Heteroaromatic compound - Dithiocarbamic acid ester - Vinylogous amide - Thiazolidine - Primary carboxylic acid amide - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organooxygen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organosulfur compound - Organohalogen compound - Organochloride - 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