Compound Identification
SMILES
Clc1ccccc1N1C(=O)NC(=O)\C(=C/c2ccc(cc2)N2CCCCCC2)C1=O
InChIKey
InChIKey=GOBKWJVIYZSQPB-OBGWFSINSA-N
Formula
C23H22ClN3O3
Mass
423.9
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
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Level 5
Pyrimidones
- Level 6 Barbituric acid derivatives
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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
Pyrimidones
Direct Parent
Barbituric acid derivatives
Alternative Parents
Dialkylarylamines Aniline and substituted anilines N-acyl ureas Chlorobenzenes Azepanes Diazinanes Aryl chlorides Dicarboximides Amino acids and derivatives Azacyclic compounds Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Barbiturate - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Azepane - Halobenzene - Ureide - N-acyl urea - Chlorobenzene - Aryl chloride - Aryl halide - Benzenoid - 1,3-diazinane - Monocyclic benzene moiety - Dicarboximide - Amino acid or derivatives - Urea - Tertiary amine - Carbonic acid derivative - Azacycle - Carboxylic acid derivative - Amine - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as barbituric acid derivatives. These are compounds containing a perhydropyrimidine ring substituted at C-2, -4 and -6 by oxo groups.
External Descriptors
Not available