Compound Identification
SMILES
[Na+].CN(C)CCC1=CN(C2=NC(=CS2)C([O-])=O)C2=C1C=CC(Cl)=C2
InChIKey
InChIKey=FHBCISVJYBZZFY-UHFFFAOYSA-M
Formula
C16H15ClN3NaO2S
Mass
371.81
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
- Subclass Tryptamines and derivatives
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Tryptamines and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Tryptamines and derivatives
Alternative Parents
3-alkylindoles Thiazolecarboxylic acids and derivatives 2,4-disubstituted thiazoles Aralkylamines Substituted pyrroles Aryl chlorides Benzenoids Heteroaromatic compounds Trialkylamines Amino acids Carboxylic acid salts Organic metal halides Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Organic oxides Organic sodium salts Organic zwitterions Organochlorides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tryptamine - 3-alkylindole - Indole - Thiazolecarboxylic acid or derivatives - 2,4-disubstituted 1,3-thiazole - Aralkylamine - Aryl chloride - Aryl halide - Benzenoid - Substituted pyrrole - Thiazole - Azole - Heteroaromatic compound - Pyrrole - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid salt - Amino acid - Organic metal halide - Carboxylic acid derivative - Azacycle - Carboxylic acid - Organic alkali metal salt - Organochloride - Organohalogen compound - Organic nitrogen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic sodium salt - Organic salt - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tryptamines and derivatives. These are compounds containing the tryptamine backbone, which is structurally characterized by an indole ring substituted at the 3-position by an ethanamine.
External Descriptors
Not available