Structure Information
Structure

Compound Identification

SMILES

OC1=CC=C(CC(CN2CCCN(CC2)C(=O)OCC2=CC=CC=C2)NS(=O)(=O)C2=CC=CC3=C2C=CN=C3)C=C1

InChIKey

InChIKey=PCXDDOHMHHQHSP-UHFFFAOYSA-N

Formula

C31H34N4O5S

Mass

574.7

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isoquinolines and derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Isoquinolines and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Amphetamine or derivatives - Benzyloxycarbonyl - Isoquinoline - 1,4-diazepane - 1-hydroxy-2-unsubstituted benzenoid - Diazepane - Phenol - Aralkylamine - Monocyclic benzene moiety - Pyridine - Organosulfonic acid amide - Benzenoid - Sulfonyl - Aminosulfonyl compound - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carbamic acid ester - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic nitrogen compound - Organosulfur compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoquinolines and derivatives. These are aromatic polycyclic compounds containing an isoquinoline moiety, which consists of a benzene ring fused to a pyridine ring and forming benzo[c]pyridine.

External Descriptors

Not available

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