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

Details

Stereochemistry ACHIRAL
Molecular Formula C18H15NO4S2
Molecular Weight 373.446
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(2,3,6,7-Tetrahydro-5,7-dioxo-6-phenyl-5H-cyclopenta[b]-1,4-dithiin-6-yl)-2,6-piperidinedione

SMILES

O=C1C2=C(SCCS2)C(=O)C1(C3CCC(=O)NC3=O)C4=CC=CC=C4

InChI

InChIKey=LEPFFVPECNZVOZ-UHFFFAOYSA-N
InChI=1S/C18H15NO4S2/c20-12-7-6-11(17(23)19-12)18(10-4-2-1-3-5-10)15(21)13-14(16(18)22)25-9-8-24-13/h1-5,11H,6-9H2,(H,19,20,23)

HIDE SMILES / InChI

Molecular Formula C18H15NO4S2
Molecular Weight 373.446
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:53:42 GMT 2025
Edited
by admin
on Mon Mar 31 21:53:42 GMT 2025
Record UNII
P466PMP8ZC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Glutarimide, 3-(5,7-dioxo-6-phenyl-2,3,6,7-tetrahydro-5H-cyclopenta-p-dithiin-6-yl)-
Preferred Name English
3-(2,3,6,7-Tetrahydro-5,7-dioxo-6-phenyl-5H-cyclopenta[b]-1,4-dithiin-6-yl)-2,6-piperidinedione
Systematic Name English
2,6-Piperidinedione, 3-(2,3,6,7-tetrahydro-5,7-dioxo-6-phenyl-5H-cyclopenta[b]-1,4-dithiin-6-yl)-
Systematic Name English
Code System Code Type Description
PUBCHEM
3059035
Created by admin on Mon Mar 31 21:53:42 GMT 2025 , Edited by admin on Mon Mar 31 21:53:42 GMT 2025
PRIMARY
CAS
76059-14-8
Created by admin on Mon Mar 31 21:53:42 GMT 2025 , Edited by admin on Mon Mar 31 21:53:42 GMT 2025
PRIMARY
FDA UNII
P466PMP8ZC
Created by admin on Mon Mar 31 21:53:42 GMT 2025 , Edited by admin on Mon Mar 31 21:53:42 GMT 2025
PRIMARY
EPA CompTox
DTXSID50997390
Created by admin on Mon Mar 31 21:53:42 GMT 2025 , Edited by admin on Mon Mar 31 21:53:42 GMT 2025
PRIMARY