Compound Identification
SMILES
ClC(=O)NC1=CC=C(C=C1)C1=NC(=O)C=C(N1)C1=CC=NC=C1
InChIKey
InChIKey=KSBOVWUDUGSWSL-UHFFFAOYSA-N
Formula
C16H11ClN4O2
Mass
326.74
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
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Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Pyrimidones
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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
Pyridines and derivatives Hydropyrimidines Benzene and substituted derivatives Vinylogous amides Heteroaromatic compounds Carbamic acid halides Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrimidone - Monocyclic benzene moiety - Hydropyrimidine - Pyridine - Benzenoid - Vinylogous amide - Heteroaromatic compound - Carbamic acid derivative - Carbamic acid halide - Azacycle - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen 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