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N-[2-[4-[[3-(tert-butylamino)-6-fluoranyl-pyridin-2-yl]-methyl-amino]piperidin-1-yl]carbonyl-1H-indol-5-yl]methanesulfonamide

View entire compound with spectra: 1 MS (GC)

N-[2-[4-[[3-(tert-butylamino)-6-fluoranyl-pyridin-2-yl]-methyl-amino]piperidin-1-yl]carbonyl-1H-indol-5-yl]methanesulfonamide
SpectraBase Compound ID Ip7Fbv0FhAI
InChI InChI=1S/C25H33FN6O3S/c1-25(2,3)29-20-8-9-22(26)28-23(20)31(4)18-10-12-32(13-11-18)24(33)21-15-16-14-17(30-36(5,34)35)6-7-19(16)27-21/h6-9,14-15,18,27,29-30H,10-13H2,1-5H3
InChIKey BIMYIIMAPXZIQL-UHFFFAOYSA-N
Mol Weight 516.6 g/mol
Molecular Formula C25H33FN6O3S
Exact Mass 516.231888 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GnqT6VmIkO3
Name N-[2-[4-[[3-(tert-butylamino)-6-fluoranyl-pyridin-2-yl]-methyl-amino]piperidin-1-yl]carbonyl-1H-indol-5-yl]methanesulfonamide
Alternate Name(s) N-[2-[4-[[3-(tert-butylamino)-6-fluoro-2-pyridyl]-methyl-amino]piperidine-1-carbonyl]-1H-indol-5-yl]methanesulfonamide N-[2-[4-[[3-(tert-butylamino)-6-fluoropyridin-2-yl]-methylamino]piperidine-1-carbonyl]-1H-indol-5-yl]methanesulfonamide N-[2-[[4-[[3-(tert-butylamino)-6-fluoro-2-pyridinyl]-methylamino]-1-piperidinyl]-oxomethyl]-1H-indol-5-yl]methanesulfonamide
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Formula C25H33FN6O3S
InChI InChI=1S/C25H33FN6O3S/c1-25(2,3)29-20-8-9-22(26)28-23(20)31(4)18-10-12-32(13-11-18)24(33)21-15-16-14-17(30-36(5,34)35)6-7-19(16)27-21/h6-9,14-15,18,27,29-30H,10-13H2,1-5H3
InChIKey BIMYIIMAPXZIQL-UHFFFAOYSA-N
Molecular Weight 516.636 g/mol
SMILES N(c1c(N(C2CCN(C(c3cc4cc(ccc4[nH]3)NS(=O)(=O)C)=O)CC2)C)nc(cc1)F)C(C)(C)C
SPLASH splash10-00kr-0960060000-404f31f8130b828de5bc
Source of Spectrum E1-39-3785-32
Wiley ID 1598986