Systematic / IUPAC Name: 1-[4-[(2S)-2-[3-[6-(2-Methoxyethylamino)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]piperidin-1-yl]ethanone
ID: Reference10700
Other Names:
Ethanone, 1-[4-[(2S)-2-[3-[6-[(2-methoxyethyl)amino]-3-pyridinyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]-1-piperidinyl]-;
NAT18-432225
Formula: C21H30N6O3
1-{4-[(2S)-2-(3-{6-[(2-Methoxyethyl)amino]-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.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 997 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 8/5/2021 2:13:07 PM |
InChI | InChI=1S/C21H30N6O3/c1-15(28)26-11-7-17(8-12-26)27-10-3-4-18(27)21-24-20(25-30-21)16-5-6-19(23-14-16)22-9-13-29-2/h5-6,14,17-18H,3-4,7-13H2,1-2H3,(H,22,23)/t18-/m0/s1 |
InChI Key | BXEKZCBILNBZHI-SFHVURJKSA-N |
Canonical SMILES | CC(=O)N1CCC(CC1)N2CCCC2C3=NC(=NO3)C4=CN=C(C=C4)NCCOC |
CAS | |
Splash | |
Other Names |
Ethanone, 1-[4-[(2S)-2-[3-[6-[(2-methoxyethyl)amino]-3-pyridinyl]-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]-1-piperidinyl]-; NAT18-432225 |