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

Details

Stereochemistry EPIMERIC
Molecular Formula C13H16N2O4S
Molecular Weight 296.342
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DUP-105

SMILES

C[S+]([O-])C1=CC=C(C=C1)N2C[C@H](CNC(C)=O)OC2=O

InChI

InChIKey=RYTTWOVTZKVWTO-ZOZMEPSFSA-N
InChI=1S/C13H16N2O4S/c1-9(16)14-7-11-8-15(13(17)19-11)10-3-5-12(6-4-10)20(2)18/h3-6,11H,7-8H2,1-2H3,(H,14,16)/t11-,20?/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H16N2O4S
Molecular Weight 296.342
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 1 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:31:15 GMT 2023
Edited
by admin
on Fri Dec 15 15:31:15 GMT 2023
Record UNII
DYQQGUHGVT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DUP-105
Code English
ACETAMIDE, N-(((5S)-3-(4-(METHYLSULFINYL)PHENYL)-2-OXO-5-OXAZOLIDINYL)METHYL)-
Systematic Name English
N-(((5S)-3-(4-(METHYLSULFINYL)PHENYL)-2-OXO-5-OXAZOLIDINYL)METHYL)ACETAMIDE
Systematic Name English
Code System Code Type Description
CAS
96800-41-8
Created by admin on Fri Dec 15 15:31:15 GMT 2023 , Edited by admin on Fri Dec 15 15:31:15 GMT 2023
PRIMARY
EPA CompTox
DTXSID80914313
Created by admin on Fri Dec 15 15:31:15 GMT 2023 , Edited by admin on Fri Dec 15 15:31:15 GMT 2023
PRIMARY
PUBCHEM
57141
Created by admin on Fri Dec 15 15:31:15 GMT 2023 , Edited by admin on Fri Dec 15 15:31:15 GMT 2023
PRIMARY
FDA UNII
DYQQGUHGVT
Created by admin on Fri Dec 15 15:31:15 GMT 2023 , Edited by admin on Fri Dec 15 15:31:15 GMT 2023
PRIMARY