Structure Information
Structure

Compound Identification

SMILES

[NH3+][C@H]1CCCC[C@H]1N=C[C@@H]1C(=O)NC(=S)N(C1=O)C1=CC=CC=C1

InChIKey

InChIKey=YREHCAYPTYHSRJ-HZSPNIEDSA-O

Formula

C17H21N4O2S

Mass

345.44

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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-phenylthioureas

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-phenylthiourea - Thiobarbiturate - Cyclohexylamine - 1,3-diazinane - 1,3-dicarbonyl compound - Quaternary ammonium salt - Amino acid or derivatives - Shiff base - Thiourea - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Aldimine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Primary aliphatic amine - Imine - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Primary amine - Amine - Organic oxide - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-phenylthioureas. These are compounds containing a N-phenylthiourea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a thiourea group.

External Descriptors

Not available

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