Structure Information
Structure

Compound Identification

SMILES

CSC1=CC=C(NC(=S)N(CCC2=CN=CN2CC2=CC=C(C=C2)C#N)CC2=C(Cl)C(Cl)=CC=C2)C=C1

InChIKey

InChIKey=ASEBARVENKPDPM-UHFFFAOYSA-N

Formula

C28H25Cl2N5S2

Mass

566.56

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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 - Benzonitrile - Aryl thioether - 1,2-dichlorobenzene - Thiophenol ether - Chlorobenzene - Halobenzene - Alkylarylthioether - Aryl halide - N-substituted imidazole - Aryl chloride - Heteroaromatic compound - Azole - Imidazole - Thiourea - Sulfenyl compound - Thioether - Azacycle - Organoheterocyclic compound - Nitrile - Carbonitrile - Organosulfur compound - Hydrocarbon derivative - Cyanide - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen 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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