Compound Identification
SMILES
CC1=CC=C(C=C1)N1C(=O)NC(=O)\C(=C/N)C1=O
InChIKey
InChIKey=BKZPRZBTKGGOSP-RMKNXTFCSA-N
Formula
C12H11N3O3
Mass
245.238
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
-
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
Toluenes N-acyl ureas Diazinanes Vinylogous amides Dicarboximides Amino acids and derivatives Enamines Azacyclic compounds Allylamines Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Barbiturate - N-acyl urea - Ureide - Toluene - Monocyclic benzene moiety - 1,3-diazinane - Benzenoid - Dicarboximide - Vinylogous amide - Amino acid or derivatives - Carbonic acid derivative - Urea - Carboxylic acid derivative - Allylamine - Enamine - Azacycle - Hydrocarbon derivative - Primary aliphatic amine - Organic nitrogen compound - Organic oxide - Amine - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary amine - 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