U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C10H11FN2O5S
Molecular Weight 290.268
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-[2-[(Acetyloxy)methyl]-1,3-oxathiolan-5-yl]-5-fluoro-2,4(1H,3H)-pyrimidinedione, cis-

SMILES

CC(=O)OC[C@@H]1O[C@@H](CS1)N2C=C(F)C(=O)NC2=O

InChI

InChIKey=UFIGLQZANSFNTH-JGVFFNPUSA-N
InChI=1S/C10H11FN2O5S/c1-5(14)17-3-8-18-7(4-19-8)13-2-6(11)9(15)12-10(13)16/h2,7-8H,3-4H2,1H3,(H,12,15,16)/t7-,8+/m0/s1

HIDE SMILES / InChI

Molecular Formula C10H11FN2O5S
Molecular Weight 290.268
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:31:11 GMT 2025
Edited
by admin
on Wed Apr 02 17:31:11 GMT 2025
Record UNII
2T24HD2YLG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-[2-[(Acetyloxy)methyl]-1,3-oxathiolan-5-yl]-5-fluoro-2,4(1H,3H)-pyrimidinedione, cis-
Common Name English
2,4(1H,3H)-Pyrimidinedione, 1-[(2R,5S)-2-[(acetyloxy)methyl]-1,3-oxathiolan-5-yl]-5-fluoro-, rel-
Preferred Name English
cis-1-[2-[(Acetyloxy)methyl]-1,3-oxathiolan-5-yl]-5-fluoro-2,4(1H,3H)-pyrimidinedione
Systematic Name English
2,4(1H,3H)-Pyrimidinedione, 1-[2-[(acetyloxy)methyl]-1,3-oxathiolan-5-yl]-5-fluoro-, cis-(±)-
Systematic Name English
2,4(1H,3H)-Pyrimidinedione, 1-[2-[(acetyloxy)methyl]-1,3-oxathiolan-5-yl]-5-fluoro-, cis-
Systematic Name English
Code System Code Type Description
CAS
144963-94-0
Created by admin on Wed Apr 02 17:31:11 GMT 2025 , Edited by admin on Wed Apr 02 17:31:11 GMT 2025
PRIMARY
FDA UNII
2T24HD2YLG
Created by admin on Wed Apr 02 17:31:11 GMT 2025 , Edited by admin on Wed Apr 02 17:31:11 GMT 2025
PRIMARY
PUBCHEM
169445153
Created by admin on Wed Apr 02 17:31:11 GMT 2025 , Edited by admin on Wed Apr 02 17:31:11 GMT 2025
PRIMARY