Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=CC(NC(=O)N[C@H]2C[C@@H]3N(C2)C(=O)[C@H](COCC2=CC=CC=C2)NC3=O)=C1

InChIKey

InChIKey=QXCHSRMPAKZHAT-FHWLQOOXSA-N

Formula

C22H23ClN4O4

Mass

442.9

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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 heteropolycyclic compounds

Substituents

Alpha-amino acid or derivatives - N-phenylurea - Benzylether - Dioxopiperazine - 2,5-dioxopiperazine - Halobenzene - Chlorobenzene - N-alkylpiperazine - Piperazine - 1,4-diazinane - Aryl chloride - Aryl halide - Tertiary carboxylic acid amide - Pyrrolidine - Urea - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Lactam - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Ether - Organooxygen compound - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organic oxide - Organohalogen 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

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