Analyte Name

N-((NE)-N-(((4-chlorophenyl)sulfonylamino)-(5-(4-chloro-2,3,5,6-tetradeuteriophenyl)-4-(2,3,4,5,6-pentadeuteriophenyl)-3,4-dihydropyrazol-2-yl)methylidene)carbamimidoyl)acetamide

Molecular Formula

C25 D9 H13 Cl2 N6 O3 S

Molecular Weight

566.507

Accurate Mass

565.142

SMILES

[2H]c1c([2H])c([2H])c(C2CN(N=C2c3c([2H])c([2H])c(Cl)c([2H])c3[2H])\C(=N/C(=N)NC(=O)C)\NS(=O)(=O)c4ccc(Cl)cc4)c([2H])c1[2H]

InChI

InChI=1S/C25H22Cl2N6O3S/c1-16(34)29-24(28)30-25(32-37(35,36)21-13-11-20(27)12-14-21)33-15-22(17-5-3-2-4-6-17)23(31-33)18-7-9-19(26)10-8-18/h2-14,22H,15H2,1H3,(H3,28,29,30,32,34)/i2D,3D,4D,5D,6D,7D,8D,9D,10D

IUPAC

N-[(NE)-N-[[(4-chlorophenyl)sulfonylamino]-[5-(4-chloro-2,3,5,6-tetradeuteriophenyl)-4-(2,3,4,5,6-pentadeuteriophenyl)-3,4-dihydropyrazol-2-yl]methylidene]carbamimidoyl]acetamide

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat