Structure Information
Structure

Compound Identification

SMILES

CN1CCN(CC2=CC3=C(C=C2)C2=NNC(=C2C3)C2=CC=C(CNC(=O)NC3=CC=CC(C)=C3)S2)CC1

InChIKey

InChIKey=JBIAJPDELARJKZ-UHFFFAOYSA-N

Formula

C29H32N6OS

Mass

512.68

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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

N-phenylurea - Aralkylamine - 2,5-disubstituted thiophene - N-alkylpiperazine - N-methylpiperazine - Toluene - 1,4-diazinane - Piperazine - Azole - Heteroaromatic compound - Pyrazole - Thiophene - Tertiary amine - Urea - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen 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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