Compound Identification
SMILES
Cl.CSC[C@H]1CN(C)[C@@H]2CC3=CNC4=CC=CC([C@H]2O1)=C34
InChIKey
InChIKey=VLYDSCUSEMFWGV-GCAQHRBDSA-N
Formula
C16H21ClN2OS
Mass
324.87
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Oxaergolines
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Oxaergolines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Oxaergolines
Alternative Parents
3-alkylindoles Isoindoles and derivatives Aralkylamines Morpholines Benzenoids Pyrroles Heteroaromatic compounds Trialkylamines Sulfenyl compounds Oxacyclic compounds Dialkylthioethers Dialkyl ethers Azacyclic compounds Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Oxaergoline skeleton - 3-alkylindole - Indole - Indole or derivatives - Isoindole or derivatives - Aralkylamine - Morpholine - Oxazinane - Benzenoid - Pyrrole - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Dialkylthioether - Dialkyl ether - Oxacycle - Sulfenyl compound - Thioether - Azacycle - Organoheterocyclic compound - Ether - Hydrochloride - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as oxaergolines. These are alkaloids with a structure based on the oxaergoline skeleton, an analog of ergoline obtained by substituted one of the pyridine C atom by an oxygen atom.
External Descriptors
Not available