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Details

Stereochemistry ACHIRAL
Molecular Formula C12H16N4O
Molecular Weight 232.2816
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MS-818 FREE BASE

SMILES

CN1CC2=NC(=NC=C2C1=O)N3CCCCC3

InChI

InChIKey=YMJJMENUYBRBET-UHFFFAOYSA-N
InChI=1S/C12H16N4O/c1-15-8-10-9(11(15)17)7-13-12(14-10)16-5-3-2-4-6-16/h7H,2-6,8H2,1H3

HIDE SMILES / InChI

Molecular Formula C12H16N4O
Molecular Weight 232.2816
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 Sat Dec 16 15:13:09 GMT 2023
Edited
by admin
on Sat Dec 16 15:13:09 GMT 2023
Record UNII
H9LS0M0NT5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MS-818 FREE BASE
Code English
5H-PYRROLO(3,4-D)PYRIMIDIN-5-ONE, 6,7-DIHYDRO-6-METHYL-2-(1-PIPERAZINYL)-
Systematic Name English
6,7-DIHYDRO-6-METHYL-2-(1-PIPERAZINYL)-5H-PYRROLO(3,4-D)PYRIMIDIN-5-ONE
Systematic Name English
Code System Code Type Description
FDA UNII
H9LS0M0NT5
Created by admin on Sat Dec 16 15:13:10 GMT 2023 , Edited by admin on Sat Dec 16 15:13:10 GMT 2023
PRIMARY
CAS
104966-11-2
Created by admin on Sat Dec 16 15:13:10 GMT 2023 , Edited by admin on Sat Dec 16 15:13:10 GMT 2023
PRIMARY
PUBCHEM
3078701
Created by admin on Sat Dec 16 15:13:10 GMT 2023 , Edited by admin on Sat Dec 16 15:13:10 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT