Structure Information
Structure

Compound Identification

SMILES

FC(F)(F)OC1=CC=C(NC(=S)N2CCC(CC2)N2[C@@H]3[C@@H](CC4=CC=CC=C34)OC2=O)C=C1

InChIKey

InChIKey=XCRAQNCAIVSAOH-UXHICEINSA-N

Formula

C23H22F3N3O3S

Mass

477.5

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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

N-phenylthiourea - Indane - Phenoxy compound - Phenol ether - Oxazolidinone - Piperidine - Oxazolidine - Carbamic acid ester - Trihalomethane - Thiourea - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Halomethane - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Alkyl fluoride - Alkyl halide - 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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