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Details

Stereochemistry ACHIRAL
Molecular Formula C23H20N2O4S
Molecular Weight 420.4829
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SULFINPYRAZONE SULFONE

SMILES

c1ccc(cc1)N2C(=O)C(CCS(=O)(=O)c3ccccc3)C(=O)N2c4ccccc4

InChI

InChIKey=DQUYGWDNTAETLI-UHFFFAOYSA-N
InChI=1S/C23H20N2O4S/c26-22-21(16-17-30(28,29)20-14-8-3-9-15-20)23(27)25(19-12-6-2-7-13-19)24(22)18-10-4-1-5-11-18/h1-15,21H,16-17H2

HIDE SMILES / InChI

Molecular Formula C23H20N2O4S
Molecular Weight 420.4829
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 14:02:37 UTC 2021
Edited
by admin
on Sat Jun 26 14:02:37 UTC 2021
Record UNII
5M9FOG2KDI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SULFINPYRAZONE SULFONE
Common Name English
SULFINPYRAZONE IMPURITY A [EP]
Common Name English
1,2-DIPHENYL-4-(2-(PHENYLSULFONYL)ETHYL)-3,5-PYRAZOLIDINEDIONE
Systematic Name English
G 31442
Code English
3,5-PYRAZOLIDINEDIONE, 1,2-DIPHENYL-4-(2-(PHENYLSULFONYL)ETHYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
70676
Created by admin on Sat Jun 26 14:02:38 UTC 2021 , Edited by admin on Sat Jun 26 14:02:38 UTC 2021
PRIMARY
ECHA (EC/EINECS)
214-169-5
Created by admin on Sat Jun 26 14:02:38 UTC 2021 , Edited by admin on Sat Jun 26 14:02:38 UTC 2021
PRIMARY
FDA UNII
5M9FOG2KDI
Created by admin on Sat Jun 26 14:02:38 UTC 2021 , Edited by admin on Sat Jun 26 14:02:38 UTC 2021
PRIMARY
CAS
1106-50-9
Created by admin on Sat Jun 26 14:02:38 UTC 2021 , Edited by admin on Sat Jun 26 14:02:38 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
Result of Sulfoxide oxidation.
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP