Structure Information
Structure

Compound Identification

SMILES

CCO.CCOC(=O)C1=C(C)NC2=C(C1C1=CC=C(C=C1)C(=O)OC)C(N)=C(S2)C(=O)C1=CC=C(Br)C=C1

InChIKey

InChIKey=SDELHLIUNYDVEC-UHFFFAOYSA-N

Formula

C28H29BrN2O6S

Mass

601.51

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Aryl ketones - Phenylketones

Direct Parent

Aryl-phenylketones

Alternative Parents

Molecular Framework

Not available

Substituents

Aryl-phenylketone - Benzoate ester - Benzoic acid or derivatives - 3,4,5-trisubstituted-2-aminothiophene - Thienopyridine - Benzoyl - Thiophene carboxylic acid or derivatives - Bromobenzene - Halobenzene - Aminothiophene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - 2-aminothiophene - Benzenoid - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Thiophene - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Enamine - Azacycle - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Alcohol - Organobromide - Organonitrogen compound - Organohalogen compound - Amine - Primary amine - Primary alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.

External Descriptors

Not available

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