Structure Information
Structure

Compound Identification

SMILES

FC1=CC(Br)=C(NC(=S)N2CCOC(COC3=C(Cl)N=CC=C3)C2)C=C1

InChIKey

InChIKey=UBXMBEMKKQBTKV-UHFFFAOYSA-N

Formula

C17H16BrClFN3O2S

Mass

460.75

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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 - Alkyl aryl ether - 2-halopyridine - Bromobenzene - Fluorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl fluoride - Aryl halide - Pyridine - Oxazinane - Morpholine - Heteroaromatic compound - Thiourea - Oxacycle - Azacycle - Organoheterocyclic compound - Dialkyl ether - Ether - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organobromide - Organochloride - 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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