Compound Identification
SMILES
CC1=CSC(=N1)[C@H]1CCCN1C(=O)C1=CC(=CC(F)=C1)C(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](O)[C@H]1CCCN1
InChIKey
InChIKey=NVDKHBDOIOWIMU-ZJSPYRCASA-N
Formula
C29H33FN4O3S
Mass
536.67
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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
3-halobenzoic acids and derivatives Benzamides Benzoyl derivatives N-acylpyrrolidines 2,4-disubstituted thiazoles Aralkylamines Fluorobenzenes Aryl fluorides Heteroaromatic compounds Tertiary carboxylic acid amides Secondary alcohols 1,2-aminoalcohols Secondary carboxylic acid amides Amino acids and derivatives Tertiary amines Dialkylamines Azacyclic compounds Organic oxides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Amphetamine or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - N-acylpyrrolidine - 2,4-disubstituted 1,3-thiazole - Aralkylamine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Pyrrolidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Thiazole - Azole - Secondary carboxylic acid amide - Secondary alcohol - Tertiary amine - Amino acid or derivatives - 1,2-aminoalcohol - Carboxamide group - Secondary amine - Secondary aliphatic amine - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organic oxide - Organic oxygen compound - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organofluoride - Amine - Alcohol - Organonitrogen compound - Aromatic heteromonocyclic 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