5-Methoxy-2-{[(2S)-2-(3-{2-[(2-methoxyethyl)amino]-3-pyridinyl}-1,2,4-oxadiazol-5-yl)-1-pyrrolidinyl]methyl}phenol
10696
Reference
5-Methoxy-2-{[(2S)-2-(3-{2-[(2-methoxyethyl)amino]-3-pyridinyl}-1,2,4-oxadiazol-5-yl)-1-pyrrolidinyl]methyl}phenol Structure
Systematic / IUPAC Name: 5-Methoxy-2-[[(2S)-2-[3-[2-(2-methoxyethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methyl]phenol
ID: Reference10696
Other Names: NAT18-429880
Formula: C22H27N5O4
Spectral Data
5-Methoxy-2-{[(2S)-2-(3-{2-[(2-methoxyethyl)amino]-3-pyridinyl}-1,2,4-oxadiazol-5-yl)-1-pyrrolidinyl]methyl}phenol 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 | 2 |
| No. of Spectra | 3142 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 8/5/2021 1:52:16 PM |
Identificators
| InChI | InChI=1S/C22H27N5O4/c1-29-12-10-24-20-17(5-3-9-23-20)21-25-22(31-26-21)18-6-4-11-27(18)14-15-7-8-16(30-2)13-19(15)28/h3,5,7-9,13,18,28H,4,6,10-12,14H2,1-2H3,(H,23,24)/t18-/m0/s1 |
| InChI Key | NTMNVSHOFJLHTL-SFHVURJKSA-N |
| Canonical SMILES | COCCNC1=C(C=CC=N1)C2=NOC(=N2)C3CCCN3CC4=C(C=C(C=C4)OC)O |
| CAS | |
| Splash | |
| Other Names | NAT18-429880 |