Structure Information
Structure

Compound Identification

SMILES

CSC1=CC=CC=C1NC(=O)N1CCCN(CC2=NOC(=N2)C2=C(C)ON=C2C)CC1

InChIKey

InChIKey=UBNBIWFWAHVOJL-UHFFFAOYSA-N

Formula

C21H26N6O3S

Mass

442.54

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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 - Aryl thioether - Thiophenol ether - 1,4-diazepane - Diazepane - Aralkylamine - Alkylarylthioether - 1,2,4-oxadiazole - Azole - Heteroaromatic compound - Isoxazole - Oxadiazole - Tertiary amine - Tertiary aliphatic amine - Urea - Thioether - Organoheterocyclic compound - Azacycle - Oxacycle - Sulfenyl compound - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Amine - 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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