Structure Information
Structure

Compound Identification

SMILES

BrC1=CC=C(OCC(=O)NC(=S)NC2=CC=C(C=C2)N2CCN(CC3=CC=CC=C3)CC2)C=C1

InChIKey

InChIKey=ZAHGKGSTBIQZKR-UHFFFAOYSA-N

Formula

C26H27BrN4O2S

Mass

539.49

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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-acyl-phenylthioureas

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-acyl-phenylthiourea - Phenylpiperazine - N-arylpiperazine - Benzylamine - Phenol ether - Phenylmethylamine - Phenoxy compound - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Halobenzene - N-alkylpiperazine - Bromobenzene - Aralkylamine - Alkyl aryl ether - 1,4-diazinane - Aryl bromide - Piperazine - Aryl halide - Tertiary aliphatic amine - Thiourea - Tertiary amine - Amino acid or derivatives - Ether - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organobromide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Amine - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-phenylthioureas. These are thiourea derivatives where one nitrogen atom of the urea group is linked to a phenyl group and the other is acylated.

External Descriptors

Not available

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