Systematic / IUPAC Name: 5-[(2S)-1-(Pyridin-4-ylmethyl)pyrrolidin-2-yl]-3-(6-pyrimidin-5-ylpyridin-3-yl)-1,2,4-oxadiazole
ID: Reference10028
Other Names:
Pyrimidine, 5-[5-[5-[(2S)-1-(4-pyridinylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinyl]-;
NAT18-440352
Formula: C21H19N7O
5-(5-{5-[(2S)-1-(4-Pyridinylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl}-2-pyridinyl)pyrimidine 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 | 540 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 10/30/2020 12:13:58 PM |
InChI | InChI=1S/C21H19N7O/c1-2-19(28(9-1)13-15-5-7-22-8-6-15)21-26-20(27-29-21)16-3-4-18(25-12-16)17-10-23-14-24-11-17/h3-8,10-12,14,19H,1-2,9,13H2/t19-/m0/s1 |
InChI Key | OWLBYAKIEQTKRG-IBGZPJMESA-N |
Canonical SMILES | C1CC(N(C1)CC2=CC=NC=C2)C3=NC(=NO3)C4=CN=C(C=C4)C5=CN=CN=C5 |
CAS | |
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Other Names |
Pyrimidine, 5-[5-[5-[(2S)-1-(4-pyridinylmethyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-2-pyridinyl]-; NAT18-440352 |