Compound Identification
SMILES
NC1=NC(=O)N(C=C1)[C@@H]1CS[C@H](CO)O1.CC1=C(C=CO1)C(=S)NC1=CC(\C=N\OC(C)(C)C)=C(Cl)C=C1
InChIKey
InChIKey=PUHNUTMAUMOSCR-RCTXQMEZSA-N
Formula
C25H30ClN5O5S2
Mass
580.12
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Nucleosides, nucleotides, and analogues
Kingdom
Organic compounds
Superclass
Nucleosides, nucleotides, and analogues
Class
Nucleoside and nucleotide analogues
Subclass
3'-thia pyrimidine nucleosides
Intermediate Tree Nodes
Not available
Direct Parent
3'-thia pyrimidine nucleosides
Alternative Parents
Aminopyrimidines and derivatives Pyrimidones Chlorobenzenes Aryl chlorides Imidolactams Hydropyrimidines Thioamides Oxathiolanes Furans Monothioacetals Heteroaromatic compounds Thiocarboxylic acid amides Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Primary alcohols Primary amines Thiocarbonyl compounds
Molecular Framework
Not available
Substituents
3'-thia pyrimidine nucleoside - Aminopyrimidine - Chlorobenzene - Halobenzene - Pyrimidone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - Pyrimidine - Benzenoid - Imidolactam - Thioamide - Heteroaromatic compound - Oxathiolane - Furan - Monothioacetal - Oxacycle - Azacycle - Organoheterocyclic compound - Thiocarboxylic acid amide - Thiocarbonyl group - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Organic oxide - Organosulfur compound - Organic oxygen compound - Primary alcohol - Amine - Primary amine - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 3'-thia pyrimidine nucleosides. These are nucleoside analogues with a structure that consists of a pyrimidine base, which is N-substituted at the 1-position with a 3'-thia derivative (1,3-oxazolidine) of the ribose moiety that is characteristic of nucleosides.
External Descriptors
Not available