2-[[3-[2-(Dimethylamino)ethyl]-1H-indol-5-yl]Methyl] Rizatriptan Benzoate

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Analyte Name

2-(2-((3-(2-(Dimethylamino)ethyl)-1H-indol-5-yl)methyl)-5-(1H-1,2,4-triazol-1-ylmethyl)-1H-indol-3-yl)-N,N-dimethylethanamine Benzoate

CAS Number

1016900-25-6

Molecular Formula

C28 H35 N7 . C7 H6 O2

Molecular Weight

591.746

Accurate Mass

591.332

SMILES

CN(C)CCc1c[nH]c2ccc(Cc3[nH]c4ccc(Cn5cncn5)cc4c3CCN(C)C)cc12.OC(=O)c6ccccc6

InChI

InChI=1S/C28H35N7.C7H6O2/c1-33(2)11-9-22-16-30-26-7-5-20(13-24(22)26)15-28-23(10-12-34(3)4)25-14-21(6-8-27(25)32-28)17-35-19-29-18-31-35;8-7(9)6-4-2-1-3-5-6/h5-8,13-14,16,18-19,30,32H,9-12,15,17H2,1-4H3;1-5H,(H,8,9)

IUPAC

benzoic acid;2-[5-[[3-[2-(dimethylamino)ethyl]-5-(1,2,4-triazol-1-ylmethyl)-1H-indol-2-yl]methyl]-1H-indol-3-yl]-N,N-dimethylethanamine

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat