Structure Information
Structure

Compound Identification

SMILES

O[C@@H]1CCN(CCN(C2CCC(CC2)C2=CC=CC(=C2)C#N)C(=O)NC2=CC(=C(F)C=C2)C(F)(F)F)C1

InChIKey

InChIKey=WVKGDXFNLLPPQP-ZUEZHPSSSA-N

Formula

C27H30F4N4O2

Mass

518.557

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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

Aromatic heteromonocyclic compounds

Substituents

Trifluoromethylbenzene - N-phenylurea - Benzonitrile - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - N-alkylpyrrolidine - Pyrrolidine - Urea - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - 1,2-aminoalcohol - Azacycle - Organoheterocyclic compound - Carbonitrile - Nitrile - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organic oxide - Cyanide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Alcohol - Organonitrogen compound - Amine - Alkyl halide - Organooxygen compound - Alkyl fluoride - Aromatic heteromonocyclic 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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