Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C=CC(=O)NC(=S)NC1=CC=CC=C1C#N

InChIKey

InChIKey=XBOLDEOMKRQNPK-UHFFFAOYSA-N

Formula

C14H13N3O3S

Mass

303.34

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

N-phenylthioureas

Intermediate Tree Nodes

Not available

Direct Parent

N-acyl-phenylthioureas

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

N-acyl-phenylthiourea - Benzonitrile - Fatty acid ester - N-acyl-amine - Fatty acyl - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Thiourea - Carboxylic acid ester - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Cyanide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-phenylthioureas. These are thiourea derivatives where one nitrogen atom of the urea group is linked to a phenyl group and the other is acylated.

External Descriptors

Not available

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