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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H20FNO3S
Molecular Weight 349.42
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of R-125689

SMILES

OC(=O)\C=C1\CN(CC[C@H]1S)[C@@H](C(=O)C2CC2)C3=C(F)C=CC=C3

InChI

InChIKey=ZWUQVNSJSJHFPS-IKTMDDPPSA-N
InChI=1S/C18H20FNO3S/c19-14-4-2-1-3-13(14)17(18(23)11-5-6-11)20-8-7-15(24)12(10-20)9-16(21)22/h1-4,9,11,15,17,24H,5-8,10H2,(H,21,22)/b12-9-/t15-,17-/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H20FNO3S
Molecular Weight 349.42
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:53:02 UTC 2023
Edited
by admin
on Sat Dec 16 09:53:02 UTC 2023
Record UNII
97EDJ67519
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
R-125689
Common Name English
ACETIC ACID, 2-((4R)-1-((1R)-2-CYCLOPROPYL-1-(2-FLUOROPHENYL)-2-OXOETHYL)-4-MERCAPTO-3-PIPERIDINYLIDENE)-, (2Z)-
Systematic Name English
R-138727, (4R,1R)-
Common Name English
Code System Code Type Description
PUBCHEM
72710769
Created by admin on Sat Dec 16 09:53:02 UTC 2023 , Edited by admin on Sat Dec 16 09:53:02 UTC 2023
PRIMARY
FDA UNII
97EDJ67519
Created by admin on Sat Dec 16 09:53:02 UTC 2023 , Edited by admin on Sat Dec 16 09:53:02 UTC 2023
PRIMARY
CAS
866761-70-8
Created by admin on Sat Dec 16 09:53:02 UTC 2023 , Edited by admin on Sat Dec 16 09:53:02 UTC 2023
PRIMARY