U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C19H25NOS
Molecular Weight 315.473
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ROTIGOTINE, (±)-

SMILES

CCCN(CCC1=CC=CS1)C2CCC3=C(C2)C=CC=C3O

InChI

InChIKey=KFQYTPMOWPVWEJ-UHFFFAOYSA-N
InChI=1S/C19H25NOS/c1-2-11-20(12-10-17-6-4-13-22-17)16-8-9-18-15(14-16)5-3-7-19(18)21/h3-7,13,16,21H,2,8-12,14H2,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
ROTIGOTINE, (±)-
Common Name English
RACEMIC N-0437
Code English
(±)-5,6,7,8-TETRAHYDRO-6-(PROPYL(2-(2-THIENYL)ETHYL)AMINO)-1-NAPHTHOL
Systematic Name English
1-NAPHTHALENOL, 5,6,7,8-TETRAHYDRO-6-(PROPYL(2-(2-THIENYL)ETHYL)AMINO)-
Systematic Name English
N-0437
Code English
(±)-N-0437
Code English
ROTIGOTINE (±)-FORM [MI]
Common Name English
Code System Code Type Description
CAS
92206-54-7
Created by admin on Fri Dec 15 15:13:54 GMT 2023 , Edited by admin on Fri Dec 15 15:13:54 GMT 2023
PRIMARY
PUBCHEM
57537
Created by admin on Fri Dec 15 15:13:54 GMT 2023 , Edited by admin on Fri Dec 15 15:13:54 GMT 2023
PRIMARY
FDA UNII
5QTR54Z0E1
Created by admin on Fri Dec 15 15:13:54 GMT 2023 , Edited by admin on Fri Dec 15 15:13:54 GMT 2023
PRIMARY
DRUG BANK
DB05271
Created by admin on Fri Dec 15 15:13:54 GMT 2023 , Edited by admin on Fri Dec 15 15:13:54 GMT 2023
PRIMARY
EPA CompTox
DTXSID60861159
Created by admin on Fri Dec 15 15:13:54 GMT 2023 , Edited by admin on Fri Dec 15 15:13:54 GMT 2023
PRIMARY
MERCK INDEX
m9674
Created by admin on Fri Dec 15 15:13:54 GMT 2023 , Edited by admin on Fri Dec 15 15:13:54 GMT 2023
PRIMARY Merck Index