Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(NC(=O)N2CCC[NH+](CC3=CC=C(C=C3)C#N)CC2)C=C1

InChIKey

InChIKey=HUCQSFGBDVKDGJ-UHFFFAOYSA-O

Formula

C21H25N4O2

Mass

365.456

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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

N-phenylurea - Methoxyaniline - Anisole - Benzonitrile - Benzylamine - Phenol ether - Phenylmethylamine - Phenoxy compound - Methoxybenzene - Aralkylamine - Alkyl aryl ether - Diazepane - 1,4-diazepane - Quaternary ammonium salt - Urea - Tertiary aliphatic amine - Tertiary amine - Nitrile - Carbonitrile - Ether - Organoheterocyclic compound - Azacycle - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Cyanide - Organic oxide - Organic cation - 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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