Compound Identification
SMILES
CC1=NN(C(=O)NC2=CC=C(Cl)C=C2)C(=O)C2CCC(=O)N12
InChIKey
InChIKey=SGLDBTHVOVYPMN-UHFFFAOYSA-N
Formula
C14H13ClN4O3
Mass
320.73
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass N-phenylureas
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
N-phenylureas
Intermediate Tree Nodes
Not available
Direct Parent
N-phenylureas
Alternative Parents
Alpha amino acids and derivatives Pyrrolotriazines N-acyl ureas Chlorobenzenes Pyrrolidine-2-ones 1,2,4-triazines Aryl chlorides Semicarbazides Dicarboximides Amidrazones Lactams Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - N-phenylurea - Pyrrolotriazine - Chlorobenzene - Halobenzene - N-acyl urea - Ureide - Aryl chloride - Aryl halide - 1,2,4-triazine - Triazine - Pyrrolidone - 2-pyrrolidone - Dicarboximide - Pyrrolidine - Semicarbazide - Carboxylic acid amidrazone - Lactam - Carbonic acid derivative - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organochloride - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea group.
External Descriptors
Not available