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

Details

Stereochemistry ACHIRAL
Molecular Formula C18H24N2O3S2
Molecular Weight 380.525
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ER-129517

SMILES

CS(=O)(=O)C1=C(CCC2CCN(CC3=CC=CNC3=O)CC2)SC=C1

InChI

InChIKey=GGDVEBNMWHSUKY-UHFFFAOYSA-N
InChI=1S/C18H24N2O3S2/c1-25(22,23)17-8-12-24-16(17)5-4-14-6-10-20(11-7-14)13-15-3-2-9-19-18(15)21/h2-3,8-9,12,14H,4-7,10-11,13H2,1H3,(H,19,21)

HIDE SMILES / InChI

Molecular Formula C18H24N2O3S2
Molecular Weight 380.525
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:25:47 GMT 2023
Edited
by admin
on Sat Dec 16 08:25:47 GMT 2023
Record UNII
U400GBB8JR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ER-129517
Common Name English
2(1H)-PYRIDINONE, 3-((4-(2-(3-(METHYLSULFONYL)-2-THIENYL)ETHYL)-1-PIPERIDINYL)METHYL)-
Systematic Name English
Code System Code Type Description
CAS
351407-14-2
Created by admin on Sat Dec 16 08:25:47 GMT 2023 , Edited by admin on Sat Dec 16 08:25:47 GMT 2023
PRIMARY
FDA UNII
U400GBB8JR
Created by admin on Sat Dec 16 08:25:47 GMT 2023 , Edited by admin on Sat Dec 16 08:25:47 GMT 2023
PRIMARY
PUBCHEM
22678296
Created by admin on Sat Dec 16 08:25:47 GMT 2023 , Edited by admin on Sat Dec 16 08:25:47 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY