N-Desmethyl Sumatriptan Hemisuccinate

Analyte Name

N-Desmethyl Sumatriptan Hemisuccinate

Molecular Formula

2(C13 H19 N3 O2 S) . C4 H6 O4

Molecular Weight

680.8358

Accurate Mass

680.2662

SMILES

CNCCc1c[nH]c2ccc(CS(=O)(=O)NC)cc12.CNCCc3c[nH]c4ccc(CS(=O)(=O)NC)cc34.OC(=O)CCC(=O)O

InChI

InChI=1S/2C13H19N3O2S.C4H6O4/c2*1-14-6-5-11-8-16-13-4-3-10(7-12(11)13)9-19(17,18)15-2;5-3(6)1-2-4(7)8/h2*3-4,7-8,14-16H,5-6,9H2,1-2H3;1-2H2,(H,5,6)(H,7,8)

IUPAC

butanedioic acid;N-methyl-1-[3-[2-(methylamino)ethyl]-1H-indol-5-yl]methanesulfonamide

Alternate CAS Number

Free compound: 88919-51-1

Storage Temperature

+20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Purity

>95% (HPLC)