Compound Identification
SMILES
CCC1=CN([C@@H]2CC=C(C[N+]3=CC=CC=C3)S2(=O)=O)C(=O)NC1=O
InChIKey
InChIKey=WRYBAXCHMXSJMT-AWEZNQCLSA-O
Formula
C16H18N3O4S
Mass
348.4
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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
Pyridinium derivatives Hydropyrimidines Vinylogous amides Sulfones Heteroaromatic compounds Dihydrothiophenes Ureas Lactams Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrimidone - Hydropyrimidine - Pyridine - Pyridinium - 2,3-dihydrothiophene - Heteroaromatic compound - Vinylogous amide - Sulfone - Lactam - Urea - Azacycle - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic cation - 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