Compound Identification
SMILES
CN1C(=O)NC2(N(C)C(=O)NC3=CC=CC=C23)C1=O
InChIKey
InChIKey=BVHCEVFMOQMYCD-UHFFFAOYSA-N
Formula
C12H12N4O3
Mass
260.253
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azolidines
-
Subclass
Imidazolidines
-
Level 5
Imidazolidinones
-
Level 6
Imidazolidinediones
-
Level 7
Hydantoins
- Level 8 Allantoins
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Level 7
Hydantoins
-
Level 6
Imidazolidinediones
-
Level 5
Imidazolidinones
-
Subclass
Imidazolidines
-
Class
Azolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azolidines
Subclass
Imidazolidines
Intermediate Tree Nodes
Imidazolidinones - Imidazolidinediones - Hydantoins
Direct Parent
Allantoins
Alternative Parents
Quinazolines Alpha amino acids and derivatives Pyrimidones N-acyl ureas Benzenoids Dicarboximides Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Allantoin - Diazanaphthalene - Alpha-amino acid or derivatives - Quinazoline - N-acyl urea - Pyrimidone - Ureide - Pyrimidine - Benzenoid - Dicarboximide - Carbonic acid derivative - Urea - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as allantoins. These are heterocyclic compounds containing an imiazolidine ring substituted by a ketone group at positions 2 and 5, and an urea at position 4.
External Descriptors
Not available