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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H27NOS
Molecular Weight 329.499
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (S)-5-METHOXY-N-PROPYL-N-(2-(THIOPHEN-2-YL)ETHYL)-1,2,3,4-TETRAHYDRONAPHTHALEN-2-AMINE

SMILES

CCCN(CCC1=CC=CS1)[C@H]2CCC3=C(C2)C=CC=C3OC

InChI

InChIKey=AXOQYAWBBDSEMG-KRWDZBQOSA-N
InChI=1S/C20H27NOS/c1-3-12-21(13-11-18-7-5-14-23-18)17-9-10-19-16(15-17)6-4-8-20(19)22-2/h4-8,14,17H,3,9-13,15H2,1-2H3/t17-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H27NOS
Molecular Weight 329.499
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:01:38 UTC 2023
Edited
by admin
on Sat Dec 16 11:01:38 UTC 2023
Record UNII
F6E9QF4TQ0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(S)-5-METHOXY-N-PROPYL-N-(2-(THIOPHEN-2-YL)ETHYL)-1,2,3,4-TETRAHYDRONAPHTHALEN-2-AMINE
Systematic Name English
N-PROPYL-N-((2S)-1,2,3,4-TETRAHYDRO-5-METHOXY-2-NAPHTHALENYL)-2-THIOPHENEETHANAMINE
Systematic Name English
ROTIGOTINE RELATED COMPOUND H [USP-RS]
Common Name English
ROTIGOTINE IMPURITY H [EP IMPURITY]
Common Name English
2-THIOPHENEETHANAMINE, N-PROPYL-N-((2S)-1,2,3,4-TETRAHYDRO-5-METHOXY-2-NAPHTHALENYL)-
Systematic Name English
METHOXY ROTIGOTINE
Common Name English
(2S)-5-METHOXY-N-PROPYL-N-(2-(THIOPHEN-2-YL)ETHYL)-1,2,3,4-TETRAHYDRONAPHTHALEN-2-AMINE
Systematic Name English
Code System Code Type Description
FDA UNII
F6E9QF4TQ0
Created by admin on Sat Dec 16 11:01:38 UTC 2023 , Edited by admin on Sat Dec 16 11:01:38 UTC 2023
PRIMARY
CAS
1148154-91-9
Created by admin on Sat Dec 16 11:01:38 UTC 2023 , Edited by admin on Sat Dec 16 11:01:38 UTC 2023
PRIMARY
RS_ITEM_NUM
1606156
Created by admin on Sat Dec 16 11:01:38 UTC 2023 , Edited by admin on Sat Dec 16 11:01:38 UTC 2023
PRIMARY
PUBCHEM
58320993
Created by admin on Sat Dec 16 11:01:38 UTC 2023 , Edited by admin on Sat Dec 16 11:01:38 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP