Compound Identification
SMILES
[O-][N+](=O)C1=CC2=C(C=C1)N=CN(CNCC(=O)NC(=O)NC1=CC=C(Cl)C=C1)C2=O
InChIKey
InChIKey=SEVFUUTUFAWAGE-UHFFFAOYSA-N
Formula
C18H15ClN6O5
Mass
430.81
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
N-phenylureas
- Level 5 N-acyl-phenylureas
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Subclass
N-phenylureas
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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-acyl-phenylureas
Alternative Parents
Alpha amino acid amides Quinazolinamines Nitroaromatic compounds Pyrimidones Chlorobenzenes N-acyl ureas Aryl chlorides Dicarboximides Heteroaromatic compounds Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Dialkylamines Organic oxoazanium compounds Organopnictogen compounds Organochlorides Organic zwitterions Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-phenylurea - Alpha-amino acid amide - Quinazolinamine - Diazanaphthalene - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Quinazoline - Nitroaromatic compound - Pyrimidone - Chlorobenzene - Halobenzene - N-acyl urea - Ureide - Pyrimidine - Aryl chloride - Aryl halide - Heteroaromatic compound - Dicarboximide - C-nitro compound - Organic nitro compound - Carbonic acid derivative - Amino acid or derivatives - Lactam - Urea - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Secondary aliphatic amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxoazanium - Organic oxide - Amine - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic zwitterion - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Carbonyl group - Organochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-phenylureas. These are urea derivatives where one nitrogen atom of the urea group is linked to a phenyl group and the other is acylated.
External Descriptors
Not available