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

Details

Stereochemistry ABSOLUTE
Molecular Formula C8H14O4S
Molecular Weight 206.259
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Diethyl mercaptosuccinate, (S)-

SMILES

CCOC(=O)C[C@@H](S)C(=O)OCC

InChI

InChIKey=KLXFSKITMRWDPM-ZCFIWIBFSA-N
InChI=1S/C8H14O4S/c1-3-11-7(9)5-6(13)8(10)12-4-2/h6,13H,3-5H2,1-2H3/t6-/m1/s1

HIDE SMILES / InChI

Molecular Formula C8H14O4S
Molecular Weight 206.259
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 Sat Dec 16 19:19:46 GMT 2023
Edited
by admin
on Sat Dec 16 19:19:46 GMT 2023
Record UNII
6AW7MS5LK7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Diethyl mercaptosuccinate, (S)-
Common Name English
1,4-Diethyl (2S)-2-mercaptobutanedioate
Systematic Name English
Butanedioic acid, mercapto-, diethyl ester, (2S)-
Systematic Name English
Butanedioic acid, mercapto-, diethyl ester, (S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
12385823
Created by admin on Sat Dec 16 19:19:46 GMT 2023 , Edited by admin on Sat Dec 16 19:19:46 GMT 2023
PRIMARY
FDA UNII
6AW7MS5LK7
Created by admin on Sat Dec 16 19:19:46 GMT 2023 , Edited by admin on Sat Dec 16 19:19:46 GMT 2023
PRIMARY
CAS
1093961-15-9
Created by admin on Sat Dec 16 19:19:46 GMT 2023 , Edited by admin on Sat Dec 16 19:19:46 GMT 2023
PRIMARY