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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H13N.CH4O3S
Molecular Weight 267.344
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RASAGILINE MESYLATE, (S)-

SMILES

CS(O)(=O)=O.C#CCN[C@H]1CCC2=CC=CC=C12

InChI

InChIKey=JDBJJCWRXSVHOQ-YDALLXLXSA-N
InChI=1S/C12H13N.CH4O3S/c1-2-9-13-12-8-7-10-5-3-4-6-11(10)12;1-5(2,3)4/h1,3-6,12-13H,7-9H2;1H3,(H,2,3,4)/t12-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C12H13N
Molecular Weight 171.2383
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula CH4O3S
Molecular Weight 96.106
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:51:13 GMT 2023
Edited
by admin
on Sat Dec 16 19:51:13 GMT 2023
Record UNII
R9GJ62AS2B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RASAGILINE MESYLATE, (S)-
Common Name English
1H-Inden-1-amine, 2,3-dihydro-N-2-propyn-1-yl-, (1S)-, methanesulfonate (1:1)
Systematic Name English
(1S)-2,3-Dihydro-N-2-propyn-1-yl-1H-inden-1-amine methanesulfonate (1:1)
Systematic Name English
(S)-N-(PROP-2-YN-1-YL)-2,3-DIHYDRO-1H-INDEN-1-AMINE METHANESULFONATE
Systematic Name English
Code System Code Type Description
PUBCHEM
16666423
Created by admin on Sat Dec 16 19:51:13 GMT 2023 , Edited by admin on Sat Dec 16 19:51:13 GMT 2023
PRIMARY
FDA UNII
R9GJ62AS2B
Created by admin on Sat Dec 16 19:51:13 GMT 2023 , Edited by admin on Sat Dec 16 19:51:13 GMT 2023
PRIMARY
CAS
202464-88-8
Created by admin on Sat Dec 16 19:51:13 GMT 2023 , Edited by admin on Sat Dec 16 19:51:13 GMT 2023
PRIMARY