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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H23NO2S
Molecular Weight 305.435
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4'-METHYLTHIOPROPRANOLOL, (S)-

SMILES

CSC1=CC=C(OC[C@@H](O)CNC(C)C)C2=C1C=CC=C2

InChI

InChIKey=BWLHQACTUPVMMP-ZDUSSCGKSA-N
InChI=1S/C17H23NO2S/c1-12(2)18-10-13(19)11-20-16-8-9-17(21-3)15-7-5-4-6-14(15)16/h4-9,12-13,18-19H,10-11H2,1-3H3/t13-/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H23NO2S
Molecular Weight 305.435
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 14:06:36 GMT 2023
Edited
by admin
on Sat Dec 16 14:06:36 GMT 2023
Record UNII
3N6QPG488B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4'-METHYLTHIOPROPRANOLOL, (S)-
Common Name English
2-PROPANOL, 1-((1-METHYLETHYL)AMINO)-3-((4-(METHYLTHIO)-1-NAPHTHALENYL)OXY)-, (S)-
Systematic Name English
Code System Code Type Description
FDA UNII
3N6QPG488B
Created by admin on Sat Dec 16 14:06:36 GMT 2023 , Edited by admin on Sat Dec 16 14:06:36 GMT 2023
PRIMARY
CAS
127708-91-2
Created by admin on Sat Dec 16 14:06:36 GMT 2023 , Edited by admin on Sat Dec 16 14:06:36 GMT 2023
PRIMARY
PUBCHEM
133082742
Created by admin on Sat Dec 16 14:06:36 GMT 2023 , Edited by admin on Sat Dec 16 14:06:36 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER