Structure Information
Structure

Compound Identification

SMILES

OC(=O)CC(O)(CC(O)=O)C(O)=O.FC1=CC=CC(F)=C1NC(=O)NC1=CNN\C1=C1/N=C2C=CC(CN3CCOCC3)=CC2=N1

InChIKey

InChIKey=UFGHKBBAWDPJEA-ANVLNOONSA-N

Formula

C28H29F2N7O9

Mass

645.577

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

N-phenylureas

Intermediate Tree Nodes

Not available

Direct Parent

N-phenylureas

Alternative Parents

Molecular Framework

Not available

Substituents

N-phenylurea - Benzimidazole - Tricarboxylic acid or derivatives - Fluorobenzene - Halobenzene - Aralkylamine - Alpha-hydroxy acid - Aryl fluoride - Aryl halide - Hydroxy acid - Morpholine - Oxazinane - Pyrazoline - Tertiary alcohol - Tertiary amine - Urea - Tertiary aliphatic amine - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Amine - Organic nitrogen compound - Alcohol - Carbonyl group - Organic oxide - Hydrazine derivative - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organofluoride - 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

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