Structure Information
Structure

Compound Identification

SMILES

CC1=CC=CC(C)=C1NC(=S)N(CCC1=CC=CC=C1)CC1=CC=CN1CC1=C(Cl)C=C(F)C=C1

InChIKey

InChIKey=MEXVLUIZNALBAW-UHFFFAOYSA-N

Formula

C29H29ClFN3S

Mass

506.08

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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 - M-xylene - Xylene - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Thiourea - Azacycle - Organoheterocyclic compound - Organofluoride - Organonitrogen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - 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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