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

Details

Stereochemistry ACHIRAL
Molecular Formula C14H17N5
Molecular Weight 255.3183
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SOTIRIMOD

SMILES

CC(C)CN1C(C)=NC2=C1C3=NC=CC=C3N=C2N

InChI

InChIKey=ZXBCLVSLRUWISJ-UHFFFAOYSA-N
InChI=1S/C14H17N5/c1-8(2)7-19-9(3)17-12-13(19)11-10(18-14(12)15)5-4-6-16-11/h4-6,8H,7H2,1-3H3,(H2,15,18)

HIDE SMILES / InChI

Molecular Formula C14H17N5
Molecular Weight 255.3183
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 Fri Dec 15 16:04:07 UTC 2023
Edited
by admin
on Fri Dec 15 16:04:07 UTC 2023
Record UNII
X04FQM7J4M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SOTIRIMOD
INN   USAN  
USAN   INN  
Official Name English
R-850
Code English
S-30594
Code English
2-Methyl-1-(2-methylpropyl)-1H-imidazo[4,5-c][1,5]naphthyridin-4-amine
Systematic Name English
sotirimod [INN]
Common Name English
SOTIRIMOD [USAN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C308
Created by admin on Fri Dec 15 16:04:07 UTC 2023 , Edited by admin on Fri Dec 15 16:04:07 UTC 2023
Code System Code Type Description
PUBCHEM
6450818
Created by admin on Fri Dec 15 16:04:07 UTC 2023 , Edited by admin on Fri Dec 15 16:04:07 UTC 2023
PRIMARY
ChEMBL
CHEMBL2107373
Created by admin on Fri Dec 15 16:04:07 UTC 2023 , Edited by admin on Fri Dec 15 16:04:07 UTC 2023
PRIMARY
CAS
227318-75-4
Created by admin on Fri Dec 15 16:04:07 UTC 2023 , Edited by admin on Fri Dec 15 16:04:07 UTC 2023
PRIMARY
FDA UNII
X04FQM7J4M
Created by admin on Fri Dec 15 16:04:07 UTC 2023 , Edited by admin on Fri Dec 15 16:04:07 UTC 2023
PRIMARY
DRUG BANK
DB05680
Created by admin on Fri Dec 15 16:04:07 UTC 2023 , Edited by admin on Fri Dec 15 16:04:07 UTC 2023
PRIMARY
SMS_ID
300000034448
Created by admin on Fri Dec 15 16:04:07 UTC 2023 , Edited by admin on Fri Dec 15 16:04:07 UTC 2023
PRIMARY
NCI_THESAURUS
C76687
Created by admin on Fri Dec 15 16:04:07 UTC 2023 , Edited by admin on Fri Dec 15 16:04:07 UTC 2023
PRIMARY
USAN
RR-12
Created by admin on Fri Dec 15 16:04:07 UTC 2023 , Edited by admin on Fri Dec 15 16:04:07 UTC 2023
PRIMARY
INN
8718
Created by admin on Fri Dec 15 16:04:07 UTC 2023 , Edited by admin on Fri Dec 15 16:04:07 UTC 2023
PRIMARY
EPA CompTox
DTXSID80177269
Created by admin on Fri Dec 15 16:04:07 UTC 2023 , Edited by admin on Fri Dec 15 16:04:07 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
Related Record Type Details
ACTIVE MOIETY