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Details

Stereochemistry UNKNOWN
Molecular Formula C23H20N2O5S
Molecular Weight 436.48
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(4-HYDROXYPHENYL)-2-PHENYL-4-(2-(PHENYLSULFONYL)ETHYL)-3,5-PYRAZOLIDINEDIONE

SMILES

OC1=CC=C(C=C1)N2N(C(=O)C(CCS(=O)(=O)C3=CC=CC=C3)C2=O)C4=CC=CC=C4

InChI

InChIKey=LZTWANPJOXEBPY-UHFFFAOYSA-N
InChI=1S/C23H20N2O5S/c26-19-13-11-18(12-14-19)25-23(28)21(22(27)24(25)17-7-3-1-4-8-17)15-16-31(29,30)20-9-5-2-6-10-20/h1-14,21,26H,15-16H2

HIDE SMILES / InChI

Molecular Formula C23H20N2O5S
Molecular Weight 436.48
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 Sat Dec 16 13:56:29 GMT 2023
Edited
by admin
on Sat Dec 16 13:56:29 GMT 2023
Record UNII
VR6G7RHH26
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(4-HYDROXYPHENYL)-2-PHENYL-4-(2-(PHENYLSULFONYL)ETHYL)-3,5-PYRAZOLIDINEDIONE
Systematic Name English
3,5-PYRAZOLIDINEDIONE, 1-(4-HYDROXYPHENYL)-2-PHENYL-4-(2-(PHENYLSULFONYL)ETHYL)-
Systematic Name English
CGP 17385
Code English
Code System Code Type Description
CAS
1107-46-6
Created by admin on Sat Dec 16 13:56:29 GMT 2023 , Edited by admin on Sat Dec 16 13:56:29 GMT 2023
PRIMARY
PUBCHEM
21524471
Created by admin on Sat Dec 16 13:56:29 GMT 2023 , Edited by admin on Sat Dec 16 13:56:29 GMT 2023
PRIMARY
FDA UNII
VR6G7RHH26
Created by admin on Sat Dec 16 13:56:29 GMT 2023 , Edited by admin on Sat Dec 16 13:56:29 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
Result of Aromatic hydroxylation