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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H24NO2S
Molecular Weight 318.454
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of TIEMONIUM, (S)-

SMILES

C[N+]3(CC[C@@](O)(C1=CC=CS1)C2=CC=CC=C2)CCOCC3

InChI

InChIKey=HJDYAOBDPZQHOD-SFHVURJKSA-N
InChI=1S/C18H24NO2S/c1-19(11-13-21-14-12-19)10-9-18(20,17-8-5-15-22-17)16-6-3-2-4-7-16/h2-8,15,20H,9-14H2,1H3/q+1/t18-/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H23NO2S
Molecular Weight 317.446
Charge 0
Count
Stereochemistry EPIMERIC
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 11:54:34 UTC 2023
Edited
by admin
on Sat Dec 16 11:54:34 UTC 2023
Record UNII
E423Y477AD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TIEMONIUM, (S)-
Common Name English
MORPHOLINIUM, 4-((3S)-3-HYDROXY-3-PHENYL-3-(2-THIENYL)PROPYL)-4-METHYL-
Systematic Name English
TIEMONIUM ION, (S)-
Common Name English
TIEMONIUM CATION, (S)-
Common Name English
Code System Code Type Description
FDA UNII
E423Y477AD
Created by admin on Sat Dec 16 11:54:34 UTC 2023 , Edited by admin on Sat Dec 16 11:54:34 UTC 2023
PRIMARY
CAS
1176319-03-1
Created by admin on Sat Dec 16 11:54:34 UTC 2023 , Edited by admin on Sat Dec 16 11:54:34 UTC 2023
PRIMARY
PUBCHEM
44225879
Created by admin on Sat Dec 16 11:54:34 UTC 2023 , Edited by admin on Sat Dec 16 11:54:34 UTC 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER