Systematic / IUPAC Name: 2-Methoxy-N-[5-[5-[(2S)-1-[(3,4,5-trimethoxyphenyl)methyl]pyrrolidin-2-yl]-1,2,4-oxadiazol-3-yl]pyrimidin-4-yl]acetamide
ID: Reference9700
Other Names:
Acetamide, 2-methoxy-N-[5-[5-[(2S)-1-[(3,4,5-trimethoxyphenyl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-4-pyrimidinyl]-;
NAT18-437281
Formula: C23H28N6O6
2-Methoxy-N-(5-{5-[(2S)-1-(3,4,5-trimethoxybenzyl)-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl}-4-pyrimidinyl)acetamide 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 | 2 |
No. of Spectra | 2329 |
Tandem Spectra | MS1, MS2, MS3, MS4, MS5, MS6 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 5/22/2020 10:25:05 AM |
InChI | InChI=1S/C23H28N6O6/c1-31-12-19(30)26-21-15(10-24-13-25-21)22-27-23(35-28-22)16-6-5-7-29(16)11-14-8-17(32-2)20(34-4)18(9-14)33-3/h8-10,13,16H,5-7,11-12H2,1-4H3,(H,24,25,26,30)/t16-/m0/s1 |
InChI Key | MQAXTFAVUDSERN-INIZCTEOSA-N |
Canonical SMILES | COCC(=O)NC1=NC=NC=C1C2=NOC(=N2)C3CCCN3CC4=CC(=C(C(=C4)OC)OC)OC |
CAS | |
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Other Names |
Acetamide, 2-methoxy-N-[5-[5-[(2S)-1-[(3,4,5-trimethoxyphenyl)methyl]-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]-4-pyrimidinyl]-; NAT18-437281 |