Compound Identification
SMILES
CC1(C)CC(=O)C2=C(C1)NC1=C([C@H]2C2=CC=CS2)C(=O)N=C(N1)SCC=C
InChIKey
InChIKey=KCVWKADFQFXOKQ-HNNXBMFYSA-N
Formula
C20H21N3O2S2
Mass
399.53
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
Pyrimidones Cyclohexenones Alkylarylthioethers Pyridines and derivatives Vinylogous amides Thiophenes Heteroaromatic compounds Allyl sulfur compounds Sulfenyl compounds Enamines Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridopyrimidine - Aryl thioether - Cyclohexenone - Alkylarylthioether - Pyrimidone - Pyridine - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Thiophene - Ketone - Allyl sulfur compound - Enamine - Azacycle - Sulfenyl compound - Thioether - Amine - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - 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