Systematic / IUPAC Name: 1-(4-Methoxyphenyl)-3-[(3S,5S)-1-methyl-5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]urea
ID: Reference9888
Other Names:
Urea, N-(4-methoxyphenyl)-N'-[(3S,5S)-1-methyl-5-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]-3-pyrrolidinyl]-;
NAT18-355841
Formula: C20H22N6O3
1-(4-Methoxyphenyl)-3-{(3S,5S)-1-methyl-5-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]-3-pyrrolidinyl}urea 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 | 2386 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 8/21/2020 6:31:33 AM |
InChI | InChI=1S/C20H22N6O3/c1-26-12-15(23-20(27)22-14-5-7-16(28-2)8-6-14)10-17(26)19-24-18(25-29-19)13-4-3-9-21-11-13/h3-9,11,15,17H,10,12H2,1-2H3,(H2,22,23,27)/t15-,17-/m0/s1 |
InChI Key | KTZRIEFABQVFJG-RDJZCZTQSA-N |
Canonical SMILES | CN1CC(CC1C2=NC(=NO2)C3=CN=CC=C3)NC(=O)NC4=CC=C(C=C4)OC |
CAS | |
Splash | |
Other Names |
Urea, N-(4-methoxyphenyl)-N'-[(3S,5S)-1-methyl-5-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]-3-pyrrolidinyl]-; NAT18-355841 |