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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H6ClNO3S
Molecular Weight 219.6467
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-((5-CHLORO-2-THIENYL)CARBONYL)GLYCINE

SMILES

c1cc(Cl)sc1C(=O)NCC(=O)O

InChI

InChIKey=HACZPPBLNKXGCR-UHFFFAOYSA-N
InChI=1S/C7H6ClNO3S/c8-5-2-1-4(13-5)7(12)9-3-6(10)11/h1-2H,3H2,(H,9,12)(H,10,11)

HIDE SMILES / InChI

Molecular Formula C7H6ClNO3S
Molecular Weight 219.6467
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 12:14:40 UTC 2021
Edited
by admin
on Sat Jun 26 12:14:40 UTC 2021
Record UNII
21S18PUU5M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-((5-CHLORO-2-THIENYL)CARBONYL)GLYCINE
Systematic Name English
GLYCINE, N-((5-CHLORO-2-THIENYL)CARBONYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
43239030
Created by admin on Sat Jun 26 12:14:40 UTC 2021 , Edited by admin on Sat Jun 26 12:14:40 UTC 2021
PRIMARY
FDA UNII
21S18PUU5M
Created by admin on Sat Jun 26 12:14:40 UTC 2021 , Edited by admin on Sat Jun 26 12:14:40 UTC 2021
PRIMARY
CAS
873009-45-1
Created by admin on Sat Jun 26 12:14:40 UTC 2021 , Edited by admin on Sat Jun 26 12:14:40 UTC 2021
PRIMARY
EPA CompTox
873009-45-1
Created by admin on Sat Jun 26 12:14:40 UTC 2021 , Edited by admin on Sat Jun 26 12:14:40 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
IN-VITRO
FECAL; URINE