Structure Information
Structure

Compound Identification

SMILES

COC1=CC(OC)=C(CCC2SC(C)C(C)N2C(=S)NC2=CC(F)=CC=C2)C=C1C#N

InChIKey

InChIKey=SHOKIJCQCGYNTA-UHFFFAOYSA-N

Formula

C23H26FN3O2S2

Mass

459.6

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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 - Dimethoxybenzene - M-dimethoxybenzene - Anisole - Phenoxy compound - Benzonitrile - Phenol ether - Methoxybenzene - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Thiazolidine - Thiourea - Hemithioaminal - Thioether - Azacycle - Organoheterocyclic compound - Dialkylthioether - Ether - Nitrile - Carbonitrile - Hydrocarbon derivative - Cyanide - Organic nitrogen compound - Organohalogen compound - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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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