Structure Information
Structure

Compound Identification

SMILES

CSC1=C2C[C@H]3NCC(C)=C[C@@H]3C3=C2C(N1)=CC=C3

InChIKey

InChIKey=ZTYYZZHHXLIHHV-BXUZGUMPSA-N

Formula

C16H18N2S

Mass

270.39

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Ergoline and derivatives

Subclass

Clavines and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Clavines and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Clavine skeleton - Benzoquinoline - Pyrroloquinoline - Quinoline - 3-alkylindole - Indole - Indole or derivatives - Isoindole or derivatives - Aryl thioether - Aralkylamine - Alkylarylthioether - Substituted pyrrole - Benzenoid - Pyrrole - Heteroaromatic compound - Thioether - Secondary amine - Organoheterocyclic compound - Azacycle - Secondary aliphatic amine - Sulfenyl compound - Organosulfur compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as clavines and derivatives. These are hydroxy and dehydro derivatives of 6,8-dimethylergolenes and the corresponding ergolines.

External Descriptors

Not available

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