Structure Information
Structure

Compound Identification

SMILES

C[C@H](N1N=C(C)C2=C(C3=CC=CC=C3S2)C1=O)C(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C

InChIKey

InChIKey=GQKRDSQTRYPSMH-RPCCPQHDSA-N

Formula

C22H27N3O2S

Mass

397.54

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiophenes

Subclass

1-benzothiophenes

Intermediate Tree Nodes

Not available

Direct Parent

1-benzothiophenes

Alternative Parents

Pyridazinones Benzenoids Thiophenes Heteroaromatic compounds Secondary carboxylic acid amides Lactams Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-benzothiophene - Pyridazinone - Pyridazine - Benzenoid - Thiophene - Heteroaromatic compound - Carboxamide group - Lactam - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-benzothiophenes. These are aromatic heterocyclic compound containing the Benzo[b]thiophene ring system.

External Descriptors

Not available

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