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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Ergoline and derivatives
- Subclass Clavines and derivatives
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Class
Ergoline and derivatives
-
Superclass
Alkaloids and derivatives
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
Benzoquinolines Pyrroloquinolines 3-alkylindoles Isoindoles and derivatives Aralkylamines Alkylarylthioethers Substituted pyrroles Benzenoids Heteroaromatic compounds Sulfenyl compounds Dialkylamines Azacyclic compounds Hydrocarbon derivatives
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