Analyte Name

tert-Butyl 5-((N-(tert-Butoxycarbonyl)-N-methylsulfamoyl)methyl)-3-((5-((N-(tert-butoxycarbonyl)-N-methylsulfamoyl)methyl)-3-(2-(dimethylamino)ethyl)-1H-indol-1-yl)methyl)-1H-indole-1-carboxylate

CAS Number

2512205-09-1

Molecular Formula

C40H57N5O10S2

Molecular Weight

832.04

Accurate Mass

831.35

SMILES

CN(S(CC1=CC2=C(C=C1)N(C(OC(C)(C)C)=O)C=C2CN3C=C(C4=C3C=CC(CS(N(C)C(OC(C)(C)C)=O)(=O)=O)=C4)CCN(C)C)(=O)=O)C(OC(C)(C)C)=O

InChI

InChI=1S/C40H57N5O10S2/c1-38(2,3)53-35(46)42(12)56(49,50)25-27-14-16-33-31(20-27)29(18-19-41(10)11)22-44(33)23-30-24-45(37(48)55-40(7,8)9)34-17-15-28(21-32(30)34)26-57(51,52)43(13)36(47)54-39(4,5)6/h14-17,20-22,24H,18-19,23,25-26H2,1-13H3

IUPAC

tert-butyl 3-[[3-[2-(dimethylamino)ethyl]-5-[[methyl-[(2-methylpropan-2-yl)oxycarbonyl]sulfamoyl]methyl]indol-1-yl]methyl]-5-[[methyl-[(2-methylpropan-2-yl)oxycarbonyl]sulfamoyl]methyl]indole-1-carboxylate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat