Analyte Name

Sonepiprazole Mesylate

CAS Number

170858-34-1

Molecular Formula

C21 H27 N3 O3 S . [C H4 O3 S]

Molecular Weight

497.63

Accurate Mass

497.17

SMILES

NS(C(C=C1)=CC=C1N(CC2)CCN2CC[C@H]3C4=CC=CC=C4CCO3)(=O)=O.CS(=O)(O)=O

InChI

InChI=1S/C21H27N3O3S.CH4O3S/c22-28(25,26)19-7-5-18(6-8-19)24-14-12-23(13-15-24)11-9-21-20-4-2-1-3-17(20)10-16-27-21;1-5(2,3)4/h1-8,21H,9-16H2,(H2,22,25,26);1H3,(H,2,3,4)/t21-;/m0./s1

IUPAC

(S)-4-(4-(2-(Isochroman-1-yl)ethyl)piperazin-1-yl)benzenesulfonamide Methanesulfonate

Country of Origin

CANADA

Product Format

Neat