Structure Information
Structure

Compound Identification

SMILES

CC(C)[C@@H]1N(CC2=C1N=C(Br)S2)C(=O)OC(C)(C)C

InChIKey

InChIKey=GNWLEKDKXLQJHA-JTQLQIEISA-N

Formula

C13H19BrN2O2S

Mass

347.27

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolines

Subclass

Pyrroline carboxylic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Pyrroline carboxylic acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrroline carboxylic acid - Heteroaromatic compound - Carbamic acid ester - Thiazole - Azole - Carbonic acid derivative - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrroline carboxylic acids. These are heterocyclic compounds containing a pyrroline ring substituted by one or more carboxylic acid groups.

External Descriptors

Not available

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