Structure Information
Structure

Compound Identification

SMILES

COC(=O)CCCOC1=CC=C(C=C1)C1=C(CC2=CC=C(CN3CCCC3)C=C2)C2=CC=CC=C2S1

InChIKey

InChIKey=LXPHHYFDWFOPMJ-UHFFFAOYSA-N

Formula

C31H33NO3S

Mass

499.67

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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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-benzothiophene - Phenylmethylamine - Phenoxy compound - Phenol ether - Benzylamine - Alkyl aryl ether - Fatty acid methyl ester - Aralkylamine - Fatty acid ester - Benzenoid - N-alkylpyrrolidine - Fatty acyl - Monocyclic benzene moiety - Pyrrolidine - Thiophene - Heteroaromatic compound - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Hydrocarbon derivative - Amine - Carbonyl group - Organic oxide - Organic oxygen compound - Organooxygen compound - Organic nitrogen 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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