Structure Information
Structure

Compound Identification

SMILES

CCCCCC(O)=O.CC(C)N1CCC(CC1)C1=CNC2=C1N=C(NC(=S)NC1=C(Br)C(Br)=CC=C1)C=C2

InChIKey

InChIKey=DPXGFJWOTCRSIP-UHFFFAOYSA-N

Formula

C28H37Br2N5O2S

Mass

667.51

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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

Not available

Substituents

N-phenylthiourea - Pyrrolopyridine - Medium-chain fatty acid - Bromobenzene - Halobenzene - Aralkylamine - Aryl bromide - Aryl halide - Pyridine - Fatty acyl - Fatty acid - Piperidine - Imidolactam - Straight chain fatty acid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Tertiary aliphatic amine - Thiourea - Tertiary amine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Carbonyl group - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - 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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