Compound Identification
SMILES
COC1=C(Cl)C=C2C(NC(=O)N(C)C22NC(=O)NC2=O)=C1
InChIKey
InChIKey=SBSBAKWTLBRYJT-UHFFFAOYSA-N
Formula
C12H11ClN4O4
Mass
310.69
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 5-monosubstituted hydantoins Anisoles Pyrimidones Alkyl aryl ethers N-acyl ureas Aryl chlorides Dicarboximides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Allantoin - Diazanaphthalene - Quinazoline - Alpha-amino acid or derivatives - Anisole - 5-monosubstituted hydantoin - N-acyl urea - Pyrimidone - Alkyl aryl ether - Ureide - Pyrimidine - Aryl halide - Aryl chloride - Benzenoid - Dicarboximide - Urea - Carbonic acid derivative - Ether - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - 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