Systematic / IUPAC Name: Ethyl 4-[[(6S)-6-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl]amino]benzoate
ID: Reference12960
Other Names: NAT22-381066
Formula: C21H24N6O4
Ethyl 4-({[(6S)-6-(3-isopropyl-1,2,4-oxadiazol-5-yl)-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]carbonyl}amino)benzoate 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 | 1540 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 1/5/2024 10:29:36 AM |
InChI | InChI=1S/C21H24N6O4/c1-4-30-20(28)13-5-7-14(8-6-13)24-21(29)27-10-16-15(22-11-23-16)9-17(27)19-25-18(12(2)3)26-31-19/h5-8,11-12,17H,4,9-10H2,1-3H3,(H,22,23)(H,24,29)/t17-/m0/s1 |
InChI Key | RFEUPSLTYHVPBP-KRWDZBQOSA-N |
Canonical SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CC3=C(CC2C4=NC(=NO4)C(C)C)N=CN3 |
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Other Names | NAT22-381066 |