Compound Identification
SMILES
[H-].[Na+].CN1C2=CN(CC3COC(C)(C)O3)C(C3=NC(C)=CS3)=C2C(=O)N(C)C1=O
InChIKey
InChIKey=WQKVSNXJLYQMHJ-UHFFFAOYSA-N
Formula
C18H23N4NaO4S
Mass
414.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrrolopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolopyrimidines
Alternative Parents
Pyrimidones 2,4-disubstituted thiazoles Ketals Substituted pyrroles Vinylogous amides 1,3-dioxolanes Heteroaromatic compounds Ureas Lactams Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Organic oxides Organic sodium salts Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolopyrimidine - 2,4-disubstituted 1,3-thiazole - Ketal - Pyrimidone - Pyrimidine - Substituted pyrrole - Meta-dioxolane - Azole - Heteroaromatic compound - Pyrrole - Thiazole - Vinylogous amide - Lactam - Urea - Organic alkali metal salt - Azacycle - Oxacycle - Acetal - Organic sodium salt - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolopyrimidines. These are compounds containing a pyrrolopyrimidine moiety, which consists of a pyrrole ring fused to a pyrimidine. Pyrrole is 5-membered ring consisting of four carbon atoms and one 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