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Details

Stereochemistry RACEMIC
Molecular Formula C12H18N2O3
Molecular Weight 243.3137
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SECOBARBITAL, (2-PROPENYL-1,1,2,3,3-D5)-

SMILES

[2H]C([2H])=C([2H])C([2H])([2H])C1(C(C)CCC)C(=O)NC(=O)NC1=O

InChI

InChIKey=KQPKPCNLIDLUMF-HHEIPOTRSA-N
InChI=1S/C12H18N2O3/c1-4-6-8(3)12(7-5-2)9(15)13-11(17)14-10(12)16/h5,8H,2,4,6-7H2,1,3H3,(H2,13,14,15,16,17)/i2D2,5D,7D2

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
SECOBARBITAL, (2-PROPENYL-1,1,2,3,3-D5)-
Common Name English
2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5-(1-METHYLBUTYL)-5-(2-PROPENYL-1,1,2,3,3-D5)-
Systematic Name English
Code System Code Type Description
CAS
145243-97-6
Created by admin on Sat Dec 16 18:20:20 GMT 2023 , Edited by admin on Sat Dec 16 18:20:20 GMT 2023
PRIMARY
PUBCHEM
117065076
Created by admin on Sat Dec 16 18:20:20 GMT 2023 , Edited by admin on Sat Dec 16 18:20:20 GMT 2023
PRIMARY
FDA UNII
FUM3HFV4F8
Created by admin on Sat Dec 16 18:20:20 GMT 2023 , Edited by admin on Sat Dec 16 18:20:20 GMT 2023
PRIMARY
NIH
NCATS
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