Compound Identification
SMILES
O[C@@H](CNCCC1=CC=C(C=C1)N=C(NC#N)NC1=CC(I)=CC=C1)C1=CN=CC=C1
InChIKey
InChIKey=DFKRMZGQHYWCSN-QFIPXVFZSA-N
Formula
C23H23IN6O
Mass
526.382
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenethylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenethylamines
Alternative Parents
Iodobenzenes Aralkylamines Pyridines and derivatives Aryl iodides Heteroaromatic compounds Secondary alcohols Guanidines 1,2-aminoalcohols Propargyl-type 1,3-dipolar organic compounds Dialkylamines Azacyclic compounds Organopnictogen compounds Organoiodides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenethylamine - Halobenzene - Iodobenzene - Aralkylamine - Aryl halide - Aryl iodide - Pyridine - Heteroaromatic compound - 1,2-aminoalcohol - Guanidine - Secondary alcohol - Secondary amine - Organic 1,3-dipolar compound - Organoheterocyclic compound - Azacycle - Propargyl-type 1,3-dipolar organic compound - Secondary aliphatic amine - Amine - Organoiodide - Organohalogen compound - Hydrocarbon derivative - Organopnictogen compound - Alcohol - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic alcohol - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenethylamines. These are compounds containing a phenethylamine moiety, which consists of a phenyl group substituted at the second position by an ethan-1-amine.
External Descriptors
Not available