Compound Identification
SMILES
ClC1=CC=C(C=C1)C1SCC(=O)N1NC1=NC(=O)CC(=O)N1
InChIKey
InChIKey=PNXAJBAMLNQNFG-UHFFFAOYSA-N
Formula
C13H11ClN4O3S
Mass
338.77
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazines
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Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Pyrimidones
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Subclass
Pyrimidines and pyrimidine derivatives
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Class
Diazines
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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
Chlorobenzenes 1,3-dicarbonyl compounds Aryl chlorides Hydropyrimidines Thiazolidines N-acylimines Guanidines Carboxylic acid hydrazides Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboximidamides Dialkylthioethers Hydrocarbon derivatives Organic oxides Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Chlorobenzene - Halobenzene - Pyrimidone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Benzenoid - 1,3-dicarbonyl compound - Thiazolidine - Carboxylic acid hydrazide - Guanidine - N-acylimine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboximidamide - Thioether - Carboxylic acid derivative - Azacycle - Dialkylthioether - Organooxygen compound - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organochloride - Carbonyl group - Organopnictogen compound - Organonitrogen compound - 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