Structure Information
Structure

Compound Identification

SMILES

CO[C@H]1CN(CC[C@H]1NC(=O)C1=C(Br)C(C#N)=C(C)N1)C1=NC(C2=NC=NN2C)=C(S1)C(O)=O

InChIKey

InChIKey=SKGHVMVIRUTLQL-NEPJUHHUSA-N

Formula

C20H21BrN8O4S

Mass

549.4

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Thiazoles

Intermediate Tree Nodes

Not available

Direct Parent

Thiazolecarboxylic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-heteroaryl carboxamide - 2,4,5-trisubstituted 1,3-thiazole - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Thiazolecarboxylic acid or derivatives - Dialkylarylamine - Aryl bromide - Aryl halide - Piperidine - Substituted pyrrole - 1,3-thiazol-2-amine - Vinylogous halide - 1,2,4-triazole - Heteroaromatic compound - Pyrrole - Tertiary amine - Secondary carboxylic acid amide - Amino acid - Carboxamide group - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Nitrile - Carbonitrile - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Amine - Cyanide - Organic nitrogen compound - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as thiazolecarboxylic acids and derivatives. These are heterocyclic compounds containing a thiazole ring which bears a carboxylic acid group (or a derivative thereof).

External Descriptors

Not available

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