Structure Information
Structure

Compound Identification

SMILES

CC(C)C[C@H](O[C@H](C1=CSC=C1)C1=CC=C(Br)C=C1)C(=O)NCC#N

InChIKey

InChIKey=GKUVARIUKRXEMT-ROUUACIJSA-N

Formula

C19H21BrN2O2S

Mass

421.35

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzylethers

Intermediate Tree Nodes

Not available

Direct Parent

Benzylethers

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzylether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Fatty acyl - Fatty amide - N-acyl-amine - Heteroaromatic compound - Thiophene - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Dialkyl ether - Ether - Organoheterocyclic compound - Carbonitrile - Nitrile - Cyanide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Carbonyl group - Organohalogen compound - Organobromide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzylethers. These are aromatic ethers with the general formula ROCR' (R = alkyl, aryl; R'=benzene).

External Descriptors

Not available

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