Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C(N1CCCNCC1)C1=CC2=CC=CC=C2S1

InChIKey

InChIKey=NUYMGLCIZGSZNO-UHFFFAOYSA-N

Formula

C21H24N2OS

Mass

352.5

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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

Phenoxy compounds Methoxybenzenes Anisoles 2,3,5-trisubstituted thiophenes Aralkylamines Alkyl aryl ethers 1,4-diazepanes Heteroaromatic compounds Trialkylamines Dialkylamines Azacyclic compounds Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-benzothiophene - Phenoxy compound - Anisole - Methoxybenzene - 2,3,5-trisubstituted thiophene - Phenol ether - 1,4-diazepane - Alkyl aryl ether - Aralkylamine - Diazepane - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Thiophene - Tertiary aliphatic amine - Tertiary amine - Ether - Secondary aliphatic amine - Azacycle - Secondary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxygen compound - 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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