Systematic / IUPAC Name: N-[[(2R,4S,5R)-5-[6-(2-Bromophenyl)-2-methylpyrimidin-4-yl]-1-azabicyclo[2.2.2]octan-2-yl]methyl]thiophene-2-sulfonamide
ID: Reference9257
Other Names:
2-Thiophenesulfonamide, N-[[(2R,4S,5R)-5-[6-(2-bromophenyl)-2-methyl-4-pyrimidinyl]-1-azabicyclo[2.2.2]oct-2-yl]methyl]-;
NAT13-368671
Formula: C23H25BrN4O2S2
N-({(2R,4S,5R)-5-[6-(2-Bromophenyl)-2-methyl-4-pyrimidinyl]-1-azabicyclo[2.2.2]oct-2-yl}methyl)-2-thiophenesulfonamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 1369 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 12/20/2019 10:05:06 AM |
InChI | InChI=1S/C23H25BrN4O2S2/c1-15-26-21(18-5-2-3-6-20(18)24)12-22(27-15)19-14-28-9-8-16(19)11-17(28)13-25-32(29,30)23-7-4-10-31-23/h2-7,10,12,16-17,19,25H,8-9,11,13-14H2,1H3/t16-,17+,19-/m0/s1 |
InChI Key | LMIUMMIJFXAZFD-SCTDSRPQSA-N |
Canonical SMILES | CC1=NC(=CC(=N1)C2CN3CCC2CC3CNS(=O)(=O)C4=CC=CS4)C5=CC=CC=C5Br |
CAS | |
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Other Names |
2-Thiophenesulfonamide, N-[[(2R,4S,5R)-5-[6-(2-bromophenyl)-2-methyl-4-pyrimidinyl]-1-azabicyclo[2.2.2]oct-2-yl]methyl]-; NAT13-368671 |