Compound Identification
SMILES
CC1=CC(=CC2=C1N\C(N2)=C1\C(NC(CO)CC2=CC(Cl)=CC=C2)=CC=NC1=O)N1C=CN=C1
InChIKey
InChIKey=XSMAYDZWDZCDJM-GYHWCHFESA-N
Formula
C25H23ClN6O2
Mass
474.95
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Phenethylamines
- Level 5 Amphetamines and derivatives
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Subclass
Phenethylamines
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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
Amphetamines and derivatives
Alternative Parents
Benzimidazoles Aralkylamines Chlorobenzenes Dihydropyridines Aryl chlorides N-substituted imidazoles Vinylogous amides Heteroaromatic compounds 1,2-aminoalcohols N-acylimines Ketene acetals Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids and derivatives Dialkylamines Enamines Carbonyl compounds Organochlorides Hydrocarbon derivatives Primary alcohols Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Amphetamine or derivatives - Benzimidazole - Halobenzene - Aralkylamine - Dihydropyridine - Chlorobenzene - N-substituted imidazole - Aryl chloride - Aryl halide - Hydropyridine - Imidazole - Heteroaromatic compound - Azole - Vinylogous amide - 1,2-aminoalcohol - N-acylimine - Ketene acetal or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Secondary aliphatic amine - Propargyl-type 1,3-dipolar organic compound - Enamine - Organic oxygen compound - Amine - Carbonyl group - Alcohol - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as amphetamines and derivatives. These are organic compounds containing or derived from 1-phenylpropan-2-amine.
External Descriptors
Not available