Compound Identification
SMILES
C[C@]1(CC2=CC=C(Br)C=C2)N2C(=CN=C2N(C1=O)C1=CC(Cl)=CC(Cl)=C1)S(=O)(=O)CCCCO
InChIKey
InChIKey=OISQKZHMDXVZKJ-HSZRJFAPSA-N
Formula
C23H22BrCl2N3O4S
Mass
587.31
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
Dichlorobenzenes Bromobenzenes Aryl bromides Aryl chlorides N-substituted imidazoles Tertiary carboxylic acid amides Sulfones Heteroaromatic compounds Amino acids and derivatives Tertiary amines Lactams Azacyclic compounds Organobromides Carbonyl compounds Organochlorides Organic oxides Hydrocarbon derivatives Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Amphetamine or derivatives - 1,3-dichlorobenzene - Bromobenzene - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - N-substituted imidazole - Sulfonyl - Sulfone - Tertiary carboxylic acid amide - Azole - Imidazole - Heteroaromatic compound - Tertiary amine - Amino acid or derivatives - Carboxamide group - Lactam - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Primary alcohol - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organic oxygen compound - Organobromide - Organochloride - Amine - Alcohol - Organonitrogen compound - Organooxygen compound - Organosulfur 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