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Details

Stereochemistry RACEMIC
Molecular Formula C22H24N2O7S
Molecular Weight 460.5
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of APREMILAST, (±)-

SMILES

CCOC1=C(OC)C=CC(=C1)C(CS(C)(=O)=O)N2C(=O)C3=C(C2=O)C(NC(C)=O)=CC=C3

InChI

InChIKey=IMOZEMNVLZVGJZ-UHFFFAOYSA-N
InChI=1S/C22H24N2O7S/c1-5-31-19-11-14(9-10-18(19)30-3)17(12-32(4,28)29)24-21(26)15-7-6-8-16(23-13(2)25)20(15)22(24)27/h6-11,17H,5,12H2,1-4H3,(H,23,25)

HIDE SMILES / InChI

Molecular Formula C22H24N2O7S
Molecular Weight 460.5
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 09:03:05 UTC 2023
Edited
by admin
on Sat Dec 16 09:03:05 UTC 2023
Record UNII
N5UK68MGDZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
APREMILAST, (±)-
Common Name English
ACETAMIDE, N-(2-(1-(3-ETHOXY-4-METHOXYPHENYL)-2-(METHYLSULFONYL)ETHYL)-2,3-DIHYDRO-1,3-DIOXO-1H-ISOINDOL-4-YL)-
Systematic Name English
APREMILAST (±)-FORM [MI]
Common Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 384812
Created by admin on Sat Dec 16 09:03:05 UTC 2023 , Edited by admin on Sat Dec 16 09:03:05 UTC 2023
NCI_THESAURUS C257
Created by admin on Sat Dec 16 09:03:05 UTC 2023 , Edited by admin on Sat Dec 16 09:03:05 UTC 2023
NCI_THESAURUS C744
Created by admin on Sat Dec 16 09:03:05 UTC 2023 , Edited by admin on Sat Dec 16 09:03:05 UTC 2023
FDA ORPHAN DRUG 622417
Created by admin on Sat Dec 16 09:03:05 UTC 2023 , Edited by admin on Sat Dec 16 09:03:05 UTC 2023
Code System Code Type Description
PUBCHEM
10151715
Created by admin on Sat Dec 16 09:03:05 UTC 2023 , Edited by admin on Sat Dec 16 09:03:05 UTC 2023
PRIMARY
FDA UNII
N5UK68MGDZ
Created by admin on Sat Dec 16 09:03:05 UTC 2023 , Edited by admin on Sat Dec 16 09:03:05 UTC 2023
PRIMARY
MERCK INDEX
m2010
Created by admin on Sat Dec 16 09:03:05 UTC 2023 , Edited by admin on Sat Dec 16 09:03:05 UTC 2023
PRIMARY Merck Index
CAS
253168-86-4
Created by admin on Sat Dec 16 09:03:05 UTC 2023 , Edited by admin on Sat Dec 16 09:03:05 UTC 2023
PRIMARY
WIKIPEDIA
Apremilast
Created by admin on Sat Dec 16 09:03:05 UTC 2023 , Edited by admin on Sat Dec 16 09:03:05 UTC 2023
PRIMARY
NCI_THESAURUS
C72703
Created by admin on Sat Dec 16 09:03:05 UTC 2023 , Edited by admin on Sat Dec 16 09:03:05 UTC 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE