Systematic / IUPAC Name: 5-[5-[(2S)-1-[(1-Methylbenzimidazol-2-yl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyrimidin-4-amine
ID: Reference9638
Other Names:
4-Pyrimidinamine, 5-[5-[(2S)-1-[(1-methyl-1H-benzimidazol-2-yl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-;
NAT18-473422
Formula: C19H20N8O
5-(5-{(2S)-1-[(1-Methyl-1H-benzimidazol-2-yl)methyl]-2-pyrrolidinyl}-1,2,4-oxadiazol-3-yl)-4-pyrimidinamine 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 | 745 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 4/24/2020 12:53:19 PM |
InChI | InChI=1S/C19H20N8O/c1-26-14-6-3-2-5-13(14)23-16(26)10-27-8-4-7-15(27)19-24-18(25-28-19)12-9-21-11-22-17(12)20/h2-3,5-6,9,11,15H,4,7-8,10H2,1H3,(H2,20,21,22)/t15-/m0/s1 |
InChI Key | KTSMOVMPJGEWKW-HNNXBMFYSA-N |
Canonical SMILES | CN1C2=CC=CC=C2N=C1CN3CCCC3C4=NC(=NO4)C5=CN=CN=C5N |
CAS | |
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Other Names |
4-Pyrimidinamine, 5-[5-[(2S)-1-[(1-methyl-1H-benzimidazol-2-yl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-; NAT18-473422 |