Compound Identification
SMILES
NC(=O)C(N1N=CC2=C1N=C(C=C2C(O)=O)C1=CN=C(NC(=O)NC2=CC=C(C=C2)C(F)(F)F)S1)N1CCOCC1
InChIKey
InChIKey=ZZGKOCHWHBVDPO-UHFFFAOYSA-N
Formula
C24H21F3N8O5S
Mass
590.54
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- 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-phenylureas
Alternative Parents
Trifluoromethylbenzenes Alpha amino acids and derivatives Pyridinecarboxylic acids Pyrazolopyridines 2,5-disubstituted thiazoles Morpholines Pyrazoles Heteroaromatic compounds Ureas Primary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Carboxylic acids Dialkyl ethers Organonitrogen compounds Carbonyl compounds Alkyl fluorides Organofluorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Trifluoromethylbenzene - N-phenylurea - Pyrazolopyridine - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - 2,5-disubstituted 1,3-thiazole - Pyridine - Oxazinane - Morpholine - Thiazole - Heteroaromatic compound - Pyrazole - Azole - Primary carboxylic acid amide - Carboxamide group - Urea - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - 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