Structure Information
Structure

Compound Identification

SMILES

OC(C1C(=O)NC(=S)NC1=O)C1=C(OCC2=CC=CC=C2)C=CC(Br)=C1

InChIKey

InChIKey=ARDPYYLRZPLEGK-UHFFFAOYSA-N

Formula

C18H15BrN2O4S

Mass

435.29

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazines

Subclass

Pyrimidines and pyrimidine derivatives

Intermediate Tree Nodes

Pyrimidones

Direct Parent

Thiobarbituric acid derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Thiobarbiturate - Phenol ether - Phenoxy compound - Halobenzene - Alkyl aryl ether - Bromobenzene - Benzenoid - 1,3-dicarbonyl compound - 1,3-diazinane - Aryl bromide - Monocyclic benzene moiety - Aryl halide - Thiourea - Secondary alcohol - Ether - Carboxylic acid derivative - Azacycle - Alcohol - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Aromatic alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as thiobarbituric acid derivatives. These are organic compounds containing a 2-thioxodihydropyrimidine-4,6(1H,5H)-dione skeleton.

External Descriptors

Not available

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