Compound Identification
SMILES
CCC1=CC2=C(CS([O-])([O-])C[C@@H]2NC[C@@H](O)[C@H](CC2=CC(F)=CC(F)=C2)NC(=O)C2=CC(C)=CC(C)=C2)C=C1
InChIKey
InChIKey=LRTIFYJRZCQDKD-YTCPBCGMSA-L
Formula
C30H34F2N2O4S
Mass
556.67
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylbutylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbutylamines
Alternative Parents
Amphetamines and derivatives Isothiochromanes 2-benzothiopyrans Benzamides m-Xylenes Benzoyl derivatives Aralkylamines Fluorobenzenes Aryl fluorides Secondary carboxylic acid amides 1,2-aminoalcohols Secondary alcohols Amino acids and derivatives Dialkylamines Organic oxides Organofluorides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbutylamine - Amphetamine or derivatives - Isothiochromane - Benzamide - Benzoic acid or derivatives - 2-benzothiopyran - Benzothiopyran - M-xylene - Xylene - Benzoyl - Fluorobenzene - Halobenzene - Aralkylamine - Aryl fluoride - Aryl halide - Secondary alcohol - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - 1,2-aminoalcohol - Organoheterocyclic compound - Secondary amine - Secondary aliphatic amine - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organohalogen compound - Organic nitrogen compound - Organofluoride - Organic anion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.
External Descriptors
Not available