1-{4-[(2S)-2-{3-[6-(1H-Imidazol-1-yl)-3-pyridinyl]-1,2,4-oxadiazol-5-yl}-1-pyrrolidinyl]-1-piperidinyl}ethanone
10672
Reference
1-{4-[(2S)-2-{3-[6-(1H-Imidazol-1-yl)-3-pyridinyl]-1,2,4-oxadiazol-5-yl}-1-pyrrolidinyl]-1-piperidinyl}ethanone Structure
Systematic / IUPAC Name: 1-[4-[(2S)-2-[3-(6-Imidazol-1-ylpyridin-3-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]piperidin-1-yl]ethanone
ID: Reference10672
Other Names: NAT18-442314
Formula: C21H25N7O2
Spectral Data
1-{4-[(2S)-2-{3-[6-(1H-Imidazol-1-yl)-3-pyridinyl]-1,2,4-oxadiazol-5-yl}-1-pyrrolidinyl]-1-piperidinyl}ethanone 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 | 425 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 7/21/2021 1:10:28 PM |
Identificators
| InChI | InChI=1S/C21H25N7O2/c1-15(29)26-10-6-17(7-11-26)28-9-2-3-18(28)21-24-20(25-30-21)16-4-5-19(23-13-16)27-12-8-22-14-27/h4-5,8,12-14,17-18H,2-3,6-7,9-11H2,1H3/t18-/m0/s1 |
| InChI Key | LXPVOMJWFHEDLJ-SFHVURJKSA-N |
| Canonical SMILES | CC(=O)N1CCC(CC1)N2CCCC2C3=NC(=NO3)C4=CN=C(C=C4)N5C=CN=C5 |
| CAS | |
| Splash | |
| Other Names | NAT18-442314 |