Structure Information
Structure

Compound Identification

SMILES

CN1C=C(C=C2C(=O)NC(=S)N(C2=O)C2=CC=C(Cl)C=C2)C(C)=N1

InChIKey

InChIKey=XYXAHCNNNAJCIP-UHFFFAOYSA-N

Formula

C16H13ClN4O2S

Mass

360.82

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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 - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - 1,3-diazinane - Azole - Heteroaromatic compound - Pyrazole - Thiourea - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organohalogen compound - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organochloride - Organonitrogen compound - Organooxygen 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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