1-Isopropyl-3-{(3S,5S)-1-methyl-5-[3-(2-naphthyl)-1,2,4-oxadiazol-5-yl]-3-pyrrolidinyl}urea
11115
Reference
1-Isopropyl-3-{(3S,5S)-1-methyl-5-[3-(2-naphthyl)-1,2,4-oxadiazol-5-yl]-3-pyrrolidinyl}urea Structure
Systematic / IUPAC Name: 1-[(3S,5S)-1-Methyl-5-(3-naphthalen-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]-3-propan-2-ylurea
ID: Reference11115
Other Names: NAT18-356076
Formula: C21H25N5O2
Spectral Data
1-Isopropyl-3-{(3S,5S)-1-methyl-5-[3-(2-naphthyl)-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.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 1 |
| No. of Spectra | 655 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 12/17/2021 12:17:31 PM |
Identificators
| InChI | InChI=1S/C21H25N5O2/c1-13(2)22-21(27)23-17-11-18(26(3)12-17)20-24-19(25-28-20)16-9-8-14-6-4-5-7-15(14)10-16/h4-10,13,17-18H,11-12H2,1-3H3,(H2,22,23,27)/t17-,18-/m0/s1 |
| InChI Key | OJNGHEDXQRHHAN-ROUUACIJSA-N |
| Canonical SMILES | CC(C)NC(=O)NC1CC(N(C1)C)C2=NC(=NO2)C3=CC4=CC=CC=C4C=C3 |
| CAS | |
| Splash | |
| Other Names | NAT18-356076 |