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Details

Stereochemistry ACHIRAL
Molecular Formula C12H14N2O4S
Molecular Weight 282.316
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GR-49336

SMILES

CNS(=O)(=O)CC1=CC=C2NC=C(CC(O)=O)C2=C1

InChI

InChIKey=HFYQCRQPYYPRAT-UHFFFAOYSA-N
InChI=1S/C12H14N2O4S/c1-13-19(17,18)7-8-2-3-11-10(4-8)9(6-14-11)5-12(15)16/h2-4,6,13-14H,5,7H2,1H3,(H,15,16)

HIDE SMILES / InChI

Molecular Formula C12H14N2O4S
Molecular Weight 282.316
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 Dec 16 09:36:58 GMT 2023
Edited
by admin
on Sat Dec 16 09:36:58 GMT 2023
Record UNII
9TH29SXE52
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GR-49336
Common Name English
1H-INDOLE-3-ACETIC ACID, 5-(((METHYLAMINO)SULFONYL)METHYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
11778526
Created by admin on Sat Dec 16 09:36:58 GMT 2023 , Edited by admin on Sat Dec 16 09:36:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID40472429
Created by admin on Sat Dec 16 09:36:58 GMT 2023 , Edited by admin on Sat Dec 16 09:36:58 GMT 2023
PRIMARY
FDA UNII
9TH29SXE52
Created by admin on Sat Dec 16 09:36:58 GMT 2023 , Edited by admin on Sat Dec 16 09:36:58 GMT 2023
PRIMARY
CAS
103628-44-0
Created by admin on Sat Dec 16 09:36:58 GMT 2023 , Edited by admin on Sat Dec 16 09:36:58 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE INACTIVE