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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H25N5O2
Molecular Weight 379.4555
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Larubrilstat

SMILES

O=C(N1CCC2(C1)CCOCC2)C3=CN=C(N[C@@H]4CCC5=NC=CC=C45)N=C3

InChI

InChIKey=WSBBIJRYOPKHQG-GOSISDBHSA-N
InChI=1S/C21H25N5O2/c27-19(26-9-5-21(14-26)6-10-28-11-7-21)15-12-23-20(24-13-15)25-18-4-3-17-16(18)2-1-8-22-17/h1-2,8,12-13,18H,3-7,9-11,14H2,(H,23,24,25)/t18-/m1/s1

HIDE SMILES / InChI

Molecular Formula C21H25N5O2
Molecular Weight 379.4555
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 20:56:22 GMT 2025
Edited
by admin
on Wed Apr 02 20:56:22 GMT 2025
Record UNII
AG6K4Y29B4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
larubrilstat [INN]
Preferred Name English
Larubrilstat
INN  
Official Name English
[2-[[(5R)-6,7-Dihydro-5H-cyclopenta[b]pyridin-5-yl]amino]-5-pyrimidinyl]-8-oxa-2-azaspiro[4.5]dec-2-ylmethanone
Systematic Name English
Methanone, [2-[[(5R)-6,7-dihydro-5H-cyclopenta[b]pyridin-5-yl]amino]-5-pyrimidinyl]-8-oxa-2-azaspiro[4.5]dec-2-yl-
Systematic Name English
(2-{[(5R)-6,7-dihydro-5H-cyclopenta[b]pyridin-5-yl]amino}pyrimidin-5-yl)(8-oxa-2-azaspiro[4.5]decan-2-yl)methanone
Systematic Name English
Code System Code Type Description
CAS
2765226-31-9
Created by admin on Wed Apr 02 20:56:22 GMT 2025 , Edited by admin on Wed Apr 02 20:56:22 GMT 2025
PRIMARY
INN
13386
Created by admin on Wed Apr 02 20:56:22 GMT 2025 , Edited by admin on Wed Apr 02 20:56:22 GMT 2025
PRIMARY
FDA UNII
AG6K4Y29B4
Created by admin on Wed Apr 02 20:56:22 GMT 2025 , Edited by admin on Wed Apr 02 20:56:22 GMT 2025
PRIMARY
PUBCHEM
167014213
Created by admin on Wed Apr 02 20:56:22 GMT 2025 , Edited by admin on Wed Apr 02 20:56:22 GMT 2025
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
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ACTIVE MOIETY