Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(NC2=CC=CC=C2N)SC2=C1C=C(C)C=C2

InChIKey

InChIKey=UTRXCMSZBSPEHC-UHFFFAOYSA-N

Formula

C18H18N2O2S

Mass

326.41

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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

3,4,5-trisubstituted-2-aminothiophenes Thiophene carboxylic acids and derivatives Aniline and substituted anilines N-arylated-2-aminothiophenes Vinylogous amides Heteroaromatic compounds Carboxylic acid esters Amino acids and derivatives Secondary amines Primary amines Organooxygen compounds Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-benzothiophene - 3,4,5-trisubstituted-2-aminothiophene - Thiophene carboxylic acid or derivatives - Aniline or substituted anilines - N-arylated-2-aminothiophene - Monocyclic benzene moiety - Benzenoid - 2-aminothiophene - Thiophene - Vinylogous amide - Heteroaromatic compound - Carboxylic acid ester - Amino acid or derivatives - Secondary amine - Carboxylic acid derivative - Organic oxide - Amine - Organic oxygen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - 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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