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

Details

Stereochemistry ACHIRAL
Molecular Formula C29H35F3N2O3
Molecular Weight 516.595
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Siponimod

SMILES

CCC1=CC(=CC=C1CN2CC(C2)C(O)=O)C(\C)=N\OCC3=CC=C(C4CCCCC4)C(=C3)C(F)(F)F

InChI

InChIKey=KIHYPELVXPAIDH-HNSNBQBZSA-N
InChI=1S/C29H35F3N2O3/c1-3-21-14-23(10-11-24(21)15-34-16-25(17-34)28(35)36)19(2)33-37-18-20-9-12-26(22-7-5-4-6-8-22)27(13-20)29(30,31)32/h9-14,22,25H,3-8,15-18H2,1-2H3,(H,35,36)/b33-19+

HIDE SMILES / InChI

Approval Year

Name Type Language
Siponimod
INN   WHO-DD  
USAN   INN  
Official Name English
1-[[4-[(1E)-1-[[[4-Cyclohexyl-3-(trifluoromethyl)phenyl]methoxy]imino]ethyl]-2-ethylphenyl]methyl]-3-azetidinecarboxylic acid
Systematic Name English
3-Azetidinecarboxylic acid, 1-[[4-[(1E)-1-[[[4-cyclohexyl-3-(trifluoromethyl)phenyl]methoxy]imino]ethyl]-2-ethylphenyl]methyl]-
Systematic Name English
siponimod [INN]
Common Name English
NVP-BAF312-NX
Code English
Siponimod [WHO-DD]
Common Name English
BAF312
Code English
BAF-312
Code English
SIPONIMOD [USAN]
Common Name English
SIPONIMOD [MI]
Common Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 437614
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
FDA ORPHAN DRUG 413413
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
NCI_THESAURUS C308
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
EU-Orphan Drug EU/3/14/1370
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
Code System Code Type Description
DAILYMED
RR6P8L282I
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY
LACTMED
Siponimod
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY
INN
9491
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY
RXCUI
2121085
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY
USAN
FG-55
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY
WIKIPEDIA
Siponimod
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY
CAS
1230487-00-9
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY
SMS_ID
100000163287
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY
MERCK INDEX
m12146
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY
PUBCHEM
44599207
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY
EPA CompTox
DTXSID40153847
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY
EVMPD
SUB177510
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY
DRUG CENTRAL
5326
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY
DRUG BANK
DB12371
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY
NCI_THESAURUS
C152368
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY
ChEMBL
CHEMBL2336071
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY
FDA UNII
RR6P8L282I
Created by admin on Sat Dec 16 01:37:15 UTC 2023 , Edited by admin on Sat Dec 16 01:37:15 UTC 2023
PRIMARY