Structure Information
Structure

Compound Identification

SMILES

CC(=N)N1CCC[C@H]1COC1=CC=C(C=C1)C(CC1=CC2=C(S1)C=CC(=C2)C(N)=N)C(O)=O

InChIKey

InChIKey=LWVOATWCBDAHLT-YDNXMHBPSA-N

Formula

C25H28N4O3S

Mass

464.58

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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 - Phenoxy compound - Phenol ether - 2,3,5-trisubstituted thiophene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Pyrrolidine - Thiophene - Heteroaromatic compound - Carboximidamide - Amidine - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Carboxylic acid derivative - Carboxylic acid amidine - Azacycle - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxygen 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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