Analyte Name

Phenamil Methanesulfonate-d5

CAS Number

2733215-72-8

Molecular Formula

C13H11D5ClN7O4S

Molecular Weight

406.86

Accurate Mass

406.1

SMILES

O=C(NC(NC1=C([2H])C([2H])=C([2H])C([2H])=C1[2H])=N)C2=NC(Cl)=C(N)N=C2N.O=S(O)(C)=O

InChI

InChI=1S/C12H12ClN7O.CH4O3S/c13-8-10(15)19-9(14)7(18-8)11(21)20-12(16)17-6-4-2-1-3-5-6;1-5(2,3)4/h1-5H,(H4,14,15,19)(H3,16,17,20,21);1H3,(H,2,3,4)/i1D,2D,3D,4D,5D;

IUPAC

3,5-diamino-6-chloro-N-(N-(phenyl-d5)carbamimidoyl)pyrazine-2-carboxamide methanesulfonate

Unlabelled CAS Number

1161-94-0

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat