Basic Searches
Searches without any special characters (listed below) will return items that contain the exact value(s) entered in the search field. This means that searching for "ASPIRIN CALCIUM" won't return any items that have "ASPIRIN GLYCINE CALCIUM" because the search term doesn't match exactly.
Boolean Operators
OR - searches with terms separated by " OR " will return items that contain any of the terms in the search.
Example: "ASPIRIN" OR "CALCIUM" will return items that have strings like "ASPIRIN GLYCINE" and "GLYCINE CALCIUM" because they contain at least one of the terms in the search.

AND - searches with terms separated by " AND " will return items that contain all the terms in the search.
Example: "ASPIRIN" AND "CALCIUM" won't return items that have strings "ASPIRIN GLYCINE" and "GLYCINE CALCIUM" because neither contain both terms, but it will return "ASPIRIN GLYCINE CALCIUM" because it contains both search terms.
version 2.7.1
Substance Class Chemical
Record UNII
WB3G8JP37G
Record Status Validated
Record Version
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Details

Stereochemistry EPIMERIC
Molecular Formula C19H25NO2S
Molecular Weight 331.472
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 2
E/Z Centers 0
Charge 0
Created by admin on Wed Aug 04 07:13:18 EDT 2021
Edited by admin on Wed Aug 04 07:13:18 EDT 2021
Structure of (2S)-5-HYDROXY-N-PROPYL-N-(2-(THIOPHEN-2-YL)ETHYL)-1,2,3,4-TETRAHYDRONAPHTHALEN-2-AMINE N-OXIDE

Systematic Names:

  • None recorded

SMILES

[H][C@@]1(CCC2=C(C1)C=CC=C2O)[N+]([O-])(CCC)CCC3=CC=CS3

InChI

WEBNUJHMZUJCTN-DJZRFWRSSA-N
InChI=1S/C19H25NO2S/c1-2-11-20(22,12-10-17-6-4-13-23-17)16-8-9-18-15(14-16)5-3-7-19(18)21/h3-7,13,16,21H,2,8-12,14H2,1H3/t16-,20?/m0/s1
Name Type Language Details Access References
(2S)-5-HYDROXY-N-PROPYL-N-(2-(THIOPHEN-2-YL)ETHYL)-1,2,3,4-TETRAHYDRONAPHTHALEN-2-AMINE N-OXIDE
Systematic Name
English  
ROTIGOTINE N-OXIDE
Common Name
English  
ROTIGOTINE IMPURITY E [EP]
Common Name
English  
Code System Code Type Description Access References
FDA UNII
WB3G8JP37G
Created by admin on Wed Aug 04 07:13:18 EDT 2021 , Edited by admin on Wed Aug 04 07:13:18 EDT 2021
PRIMARY
PUBCHEM
129318808
Created by admin on Wed Aug 04 07:13:18 EDT 2021 , Edited by admin on Wed Aug 04 07:13:18 EDT 2021
PRIMARY
Related Record Type Details Access References
PARENT -> IMPURITY
Mediator Substance Details
none
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Created by admin on Wed Aug 04 07:13:18 EDT 2021 , Edited by admin on Wed Aug 04 07:13:18 EDT 2021
Created Wed Aug 04 07:13:18 EDT 2021
Created By admin
Last Edited Wed Aug 04 07:13:18 EDT 2021
Last Edited By admin
Index Source Text / Citation Source Type Tags Date Accessed File Access
1 dump-public-2021-07-22_UPDATED.gsrs BATCH_IMPORT Wed Aug 04 07:13:18 EDT 2021
2 PUBCHEM PUBCHEM
3 European Pharmacopoeia Online 9.8, Rotigotine Monograph EP PUBLIC_DOMAIN_RELEASE

Molecular Formula C19H25NO2S
Molecular Weight 331.472
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 1 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED