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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H17NO2S
Molecular Weight 239.334
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PNU 180222

SMILES

CS(=O)(=O)C1=CC=CC(=C1)[C@@H]2CCCNC2

InChI

InChIKey=KMVLMAUQHRUFDO-LLVKDONJSA-N
InChI=1S/C12H17NO2S/c1-16(14,15)12-6-2-4-10(8-12)11-5-3-7-13-9-11/h2,4,6,8,11,13H,3,5,7,9H2,1H3/t11-/m1/s1

HIDE SMILES / InChI

Molecular Formula C12H17NO2S
Molecular Weight 239.334
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 Thu Jul 06 22:03:15 UTC 2023
Edited
by admin
on Thu Jul 06 22:03:15 UTC 2023
Record UNII
WA0BU02HD7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PNU 180222
Code English
(3S)-3-(3-(METHYLSULFONYL)PHENYL)PIPERIDINE
Systematic Name English
PIPERIDINE, 3-(3-(METHYLSULFONYL)PHENYL)-, (3S)-
Systematic Name English
N-DEPROPYL-(-)-OSU 6162
Common Name English
Code System Code Type Description
CAS
160777-45-7
Created by admin on Thu Jul 06 22:03:15 UTC 2023 , Edited by admin on Thu Jul 06 22:03:15 UTC 2023
PRIMARY
EPA CompTox
DTXSID501260125
Created by admin on Thu Jul 06 22:03:15 UTC 2023 , Edited by admin on Thu Jul 06 22:03:15 UTC 2023
PRIMARY
FDA UNII
WA0BU02HD7
Created by admin on Thu Jul 06 22:03:15 UTC 2023 , Edited by admin on Thu Jul 06 22:03:15 UTC 2023
PRIMARY
PUBCHEM
10466781
Created by admin on Thu Jul 06 22:03:15 UTC 2023 , Edited by admin on Thu Jul 06 22:03:15 UTC 2023
PRIMARY
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