Compound Identification
SMILES
C[C@H](O)C(=S)[C@H]1O[C@H]([C@H](O)[C@H]1F)n1ccc(=O)[nH]c1=O
InChIKey
InChIKey=QNCOQISIPIMIOC-BDYQZXKHSA-N
Formula
C11H13FN2O5S
Mass
304.29
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Pyrimidones
-
Subclass
Pyrimidines and pyrimidine derivatives
-
Class
Diazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyrimidones
Alternative Parents
Hydropyrimidines Vinylogous amides Oxolanes Heteroaromatic compounds Ureas Thioketones Secondary alcohols Fluorohydrins Lactams Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrimidone - Hydropyrimidine - Oxolane - Vinylogous amide - Heteroaromatic compound - Fluorohydrin - Urea - Thioketone - Halohydrin - Secondary alcohol - Lactam - Oxacycle - Azacycle - Organic oxide - Alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Thiocarbonyl group - Alkyl fluoride - Alkyl halide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrimidones. These are compounds that contain a pyrimidine ring, which bears a ketone. 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