Structure Information
Structure

Compound Identification

SMILES

COC(=O)C=C(NC1=C(Br)SC2=C(C=C(C)C=C2)C1=O)C(=O)OC

InChIKey

InChIKey=CRWRLYVQKPQSLM-UHFFFAOYSA-N

Formula

C16H14BrNO5S

Mass

412.25

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Thiochromenes

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Thiochromenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid or derivatives - Thiochromene - 1-benzothiopyran - Benzothiopyran - Fatty acid ester - Aryl bromide - Aryl halide - Dicarboxylic acid or derivatives - Benzenoid - Fatty acyl - Heteroaromatic compound - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Vinylogous amide - Vinylogous halide - Carboxylic acid ester - Carboxylic acid derivative - Enamine - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxide - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as thiochromenes. These are organosulfur compounds that are analogues to chromene, with the difference that a sulfur atom replaces the oxygen atom.

External Descriptors

Not available

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