Analyte Name

Pyrazolosalicyloyl Imide-d3

Molecular Formula

C20 D3 H23 N6 O7 S

Molecular Weight

497.54

Accurate Mass

497.177

SMILES

[2H]C([2H])([2H])N1CCN(CC1)S(=O)(=O)c2ccc(O)c(c2)C(=O)NC(=O)c3c(c(CCC)nn3C)[N+](=O)[O-]

InChI

InChI=1S/C20H26N6O7S/c1-4-5-15-17(26(30)31)18(24(3)22-15)20(29)21-19(28)14-12-13(6-7-16(14)27)34(32,33)25-10-8-23(2)9-11-25/h6-7,12,27H,4-5,8-11H2,1-3H3,(H,21,28,29)/i2D3

IUPAC

N-[2-hydroxy-5-[4-(trideuteriomethyl)piperazin-1-yl]sulfonylbenzoyl]-2-methyl-4-nitro-5-propylpyrazole-3-carboxamide

Unlabelled CAS Number

1798027-05-0

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat