Compound Identification
SMILES
CC1=CC2=NC(Cl)=C(\C=N\NC(=O)[C@@H](N)CC3=CNC4=CC=CC=C34)C=C2C=C1
InChIKey
InChIKey=NNISFGDLAFEGNX-XIMCHAMWSA-N
Formula
C22H20ClN5O
Mass
405.89
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
Chloroquinolines Alpha amino acids and derivatives 3-alkylindoles Aralkylamines 2-halopyridines Substituted pyrroles Benzenoids Aryl chlorides Heteroaromatic compounds Azacyclic compounds Organochlorides Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triptan - Haloquinoline - Chloroquinoline - Alpha-amino acid or derivatives - Quinoline - 3-alkylindole - Indole - 2-halopyridine - Aralkylamine - Aryl chloride - Aryl halide - Pyridine - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Amino acid or derivatives - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Primary aliphatic amine - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Amine - 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