Structure Information
Structure

Compound Identification

SMILES

ClC1=CC(Cl)=C(C=C1)C1=CSC(=N1)N1CC2CC(C1)C1=CC=CC(=O)N1C2

InChIKey

InChIKey=GCFVUYPNDBTJHJ-UHFFFAOYSA-N

Formula

C20H17Cl2N3OS

Mass

418.34

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Lupin alkaloids

Subclass

Cytisine and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Cytisine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cytisine - 1,3-dichlorobenzene - Dialkylarylamine - 2,4-disubstituted 1,3-thiazole - Chlorobenzene - Halobenzene - Pyridinone - 1,3-thiazol-2-amine - Aryl halide - Benzenoid - Monocyclic benzene moiety - Aryl chloride - Pyridine - Piperidine - Heteroaromatic compound - Azole - Thiazole - Lactam - Azacycle - Organoheterocyclic compound - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cytisine and derivatives. These are lupin alkaloids with a structure based on the cytisine skeleton, which is a tetracyclic ketone containing fused pyridine and piperidine rings that form pyrido[1,2a][1,5]diazocin-8-one.

External Descriptors

Not available

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