Structure Information
Structure

Compound Identification

SMILES

CCC1=CC=CC(CC)=C1NC(=O)N1C=C2NN=C(NC(=O)C3=CC=C(C=C3)N3CCN(C)C=C3)C2=C1

InChIKey

InChIKey=YYFQICSAIZNMBE-UHFFFAOYSA-N

Formula

C28H31N7O2

Mass

497.603

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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

Aminobenzoic acid or derivatives - N-phenylurea - Benzamide - Benzoic acid or derivatives - Benzoyl - Pyrrole-1-carboxamide - Aniline or substituted anilines - Pyrrole-1-carboxylic acid or derivatives - Pyrrolopyrazole - Imidolactam - Substituted pyrrole - Pyrrole - Azole - Pyrazole - Heteroaromatic compound - Tertiary amine - Amino acid or derivatives - Secondary carboxylic acid amide - Urea - Tertiary aliphatic amine - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Enamine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organooxygen compound - Organic nitrogen compound - Organonitrogen 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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