N-(2-Methoxyethyl)-3-(5-{(2S)-1-[4-(methylsulfonyl)benzyl]-2-pyrrolidinyl}-1,2,4-oxadiazol-3-yl)-2-pyridinamine
10710
Reference
N-(2-Methoxyethyl)-3-(5-{(2S)-1-[4-(methylsulfonyl)benzyl]-2-pyrrolidinyl}-1,2,4-oxadiazol-3-yl)-2-pyridinamine Structure
Systematic / IUPAC Name: N-(2-Methoxyethyl)-3-[5-[(2S)-1-[(4-methylsulfonylphenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyridin-2-amine
ID: Reference10710
Other Names: NAT18-429886
Formula: C22H27N5O4S
Spectral Data
N-(2-Methoxyethyl)-3-(5-{(2S)-1-[4-(methylsulfonyl)benzyl]-2-pyrrolidinyl}-1,2,4-oxadiazol-3-yl)-2-pyridinamine 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 | 2584 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 8/5/2021 6:26:32 PM |
Identificators
| InChI | InChI=1S/C22H27N5O4S/c1-30-14-12-24-20-18(5-3-11-23-20)21-25-22(31-26-21)19-6-4-13-27(19)15-16-7-9-17(10-8-16)32(2,28)29/h3,5,7-11,19H,4,6,12-15H2,1-2H3,(H,23,24)/t19-/m0/s1 |
| InChI Key | YTBVXDTVVMGKQD-IBGZPJMESA-N |
| Canonical SMILES | COCCNC1=C(C=CC=N1)C2=NOC(=N2)C3CCCN3CC4=CC=C(C=C4)S(=O)(=O)C |
| CAS | |
| Splash | |
| Other Names | NAT18-429886 |