Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(NC=C(C#N)C2=NC(=CS2)C2=CC=C(Br)C=C2)SC(C(C)=O)=C1C

InChIKey

InChIKey=BWPRMVIKTMTPLL-UHFFFAOYSA-N

Formula

C22H18BrN3O3S2

Mass

516.43

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Thiophenes

Subclass

Aminothiophenes

Intermediate Tree Nodes

2-aminothiophenes

Direct Parent

3,4,5-trisubstituted-2-aminothiophenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

3,4,5-trisubstituted-2-aminothiophene - Thiophene carboxylic acid or derivatives - Aryl ketone - Aryl alkyl ketone - 2,4-disubstituted 1,3-thiazole - Halobenzene - Bromobenzene - Aryl bromide - Aryl halide - Benzenoid - Monocyclic benzene moiety - Azole - Thiazole - Vinylogous amide - Heteroaromatic compound - Carboxylic acid ester - Ketone - Azacycle - Carboxylic acid derivative - Enamine - Carbonitrile - Nitrile - Organooxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organobromide - Organic oxygen compound - Cyanide - Organohalogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 3,4,5-trisubstituted-2-aminothiophenes. These are organic compounds containing a thiophene ring substituted at the 2-,3-,4-, and 5-position, with an amine group at the 2-position.

External Descriptors

Not available

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