(N,N-Dimethyl-1-butanamine) Zolmitriptan Dimer

Analyte Name

(4S,4'S-4,4'-[[4-(Dimethylamino)butane-1,1-diyl]bis[[3-[2-(dimethylamino)ethyl]-1H-indole-2,5-diyl]methanediyl]]bis(1,3-oxazolidin-2-one)

CAS Number

1350928-05-0

Molecular Formula

C38H53N7O4

Molecular Weight

671.87

Accurate Mass

671.416

SMILES

CN(C)CCCC(c1[nH]c2ccc(C[C@H]3COC(=O)N3)cc2c1CCN(C)C)c4[nH]c5ccc(C[C@H]6COC(=O)N6)cc5c4CCN(C)C

InChI

InChI=1S/C38H53N7O4/c1-43(2)15-7-8-30(35-28(13-16-44(3)4)31-20-24(9-11-33(31)41-35)18-26-22-48-37(46)39-26)36-29(14-17-45(5)6)32-21-25(10-12-34(32)42-36)19-27-23-49-38(47)40-27/h9-12,20-21,26-27,30,41-42H,7-8,13-19,22-23H2,1-6H3,(H,39,46)(H,40,47)/t26-,27-/m0/s1

IUPAC

(4S)-4-[[2-[4-(dimethylamino)-1-[3-[2-(dimethylamino)ethyl]-5-[[(4S)-2-oxooxazolidin-4-yl]methyl]-1H-indol-2-yl]butyl]-3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methyl]oxazolidin-2-one

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

API Family

Zolmitriptan