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-N
Formula
C30H36F2N2O4S
Mass
558.68
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
Isothiochromanes Amphetamines and derivatives 2-benzothiopyrans Benzamides m-Xylenes Benzoyl derivatives Fluorobenzenes Aralkylamines Aryl fluorides Secondary carboxylic acid amides Secondary alcohols 1,2-aminoalcohols Amino acids and derivatives Dialkylamines Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbutylamine - Isothiochromane - Amphetamine or derivatives - Benzoic acid or derivatives - Benzamide - Benzothiopyran - 2-benzothiopyran - Benzoyl - Xylene - M-xylene - Aralkylamine - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Secondary carboxylic acid amide - 1,2-aminoalcohol - Secondary alcohol - Amino acid or derivatives - Carboxamide group - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Organonitrogen compound - Organooxygen compound - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organofluoride - Amine - Organic oxygen compound - Organohalogen compound - 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