Structure Information
Structure

Compound Identification

SMILES

Cl.O=C1C(NC(=S)NC2=CC=CC=C2)SC2=NC3=CC=CC=C3N12

InChIKey

InChIKey=TWXVGIJTUSQVDH-UHFFFAOYSA-N

Formula

C16H13ClN4OS2

Mass

376.88

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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 heteropolycyclic compounds

Substituents

Alpha-amino acid or derivatives - N-phenylthiourea - Benzimidazole - Aryl thioether - N-acylimidazole - Alkylarylthioether - N-substituted imidazole - Azole - Imidazole - Heteroaromatic compound - Lactam - Thiourea - Thioether - Azacycle - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrochloride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic 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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