Structure Information
Structure

Compound Identification

SMILES

COC(=O)CCCN(CCCNC(=S)NC1=CC=C(Br)C=C1)C1CCCC2=CC=CC=C12

InChIKey

InChIKey=KEFOXDCQJHGBFS-UHFFFAOYSA-N

Formula

C25H32BrN3O2S

Mass

518.51

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Tetralins

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Tetralins

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

N-phenylthiourea - Tetralin - Aralkylamine - Fatty acid methyl ester - Halobenzene - Fatty acid ester - Bromobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Methyl ester - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Thiourea - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Amine - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane.

External Descriptors

Not available

Previous Back Next