Compound Identification
SMILES
O=C1NC(NC2=CC=CNC2=S)=NC=C1
InChIKey
InChIKey=ZCMLIDBSBFJNNQ-UHFFFAOYSA-N
Formula
C9H8N4OS
Mass
220.25
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Pyrimidones
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Subclass
Pyrimidines and pyrimidine derivatives
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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
Dihydropyridines Aminopyrimidines and derivatives Aminopyridines and derivatives Hydropyrimidines Thiolactams Heteroaromatic compounds Lactams Secondary amines Azacyclic compounds Organosulfur compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aminopyridine - Aminopyrimidine - Dihydropyridine - Pyrimidone - Hydropyridine - Hydropyrimidine - Pyridine - Heteroaromatic compound - Thiolactam - Lactam - Azacycle - Secondary amine - Organonitrogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organosulfur compound - 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