3-{[(2S)-2-{3-[6-(4-Morpholinyl)-3-pyridinyl]-1,2,4-oxadiazol-5-yl}-1-pyrrolidinyl]methyl}benzonitrile
11540
Reference
3-{[(2S)-2-{3-[6-(4-Morpholinyl)-3-pyridinyl]-1,2,4-oxadiazol-5-yl}-1-pyrrolidinyl]methyl}benzonitrile Structure
Systematic / IUPAC Name: 3-[[(2S)-2-[3-(6-Morpholin-4-ylpyridin-3-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]benzonitrile
ID: Reference11540
Other Names: NAT18-432346
Formula: C23H24N6O2
Spectral Data
3-{[(2S)-2-{3-[6-(4-Morpholinyl)-3-pyridinyl]-1,2,4-oxadiazol-5-yl}-1-pyrrolidinyl]methyl}benzonitrile mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 1 |
| No. of Spectra | 830 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 7/7/2022 7:30:20 AM |
Identificators
| InChI | InChI=1S/C23H24N6O2/c24-14-17-3-1-4-18(13-17)16-29-8-2-5-20(29)23-26-22(27-31-23)19-6-7-21(25-15-19)28-9-11-30-12-10-28/h1,3-4,6-7,13,15,20H,2,5,8-12,16H2/t20-/m0/s1 |
| InChI Key | MBSHXXODJGMEPH-FQEVSTJZSA-N |
| Canonical SMILES | C1CC(N(C1)CC2=CC(=CC=C2)C#N)C3=NC(=NO3)C4=CN=C(C=C4)N5CCOCC5 |
| CAS | |
| Splash | |
| Other Names | NAT18-432346 |