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Details

Stereochemistry RACEMIC
Molecular Formula C10H15N2O3.Na
Molecular Weight 234.2275
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 5-METHYL-5-(1-METHYLBUTYL)BARBITURATE

SMILES

[Na+].CCCC(C)C1(C)C(=O)NC(=O)[N-]C1=O

InChI

InChIKey=ICIIPNSSVFOWFW-UHFFFAOYSA-M
InChI=1S/C10H16N2O3.Na/c1-4-5-6(2)10(3)7(13)11-9(15)12-8(10)14;/h6H,4-5H2,1-3H3,(H2,11,12,13,14,15);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.98976928
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C10H16N2O3
Molecular Weight 212.2456
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 Tue Apr 01 19:56:43 GMT 2025
Edited
by admin
on Tue Apr 01 19:56:43 GMT 2025
Record UNII
748FTG93EX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BARBITURIC ACID, 5-METHYL-5-(1-METHYLBUTYL)-, SODIUM SALT
Preferred Name English
SODIUM 5-METHYL-5-(1-METHYLBUTYL)BARBITURATE
Common Name English
2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5-METHYL-5-(1-METHYLBUTYL)-, SODIUM SALT
Systematic Name English
Code System Code Type Description
FDA UNII
748FTG93EX
Created by admin on Tue Apr 01 19:56:43 GMT 2025 , Edited by admin on Tue Apr 01 19:56:43 GMT 2025
PRIMARY
PUBCHEM
23720364
Created by admin on Tue Apr 01 19:56:43 GMT 2025 , Edited by admin on Tue Apr 01 19:56:43 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE