2-{[(4-Acetylphenyl)carbamoyl]amino}-1,4:3,6-dianhydro-2,5-dideoxy-5-{[4-(2-furyl)-2-pyrimidinyl]amino}-L-iditol
10537
Reference
2-{[(4-Acetylphenyl)carbamoyl]amino}-1,4:3,6-dianhydro-2,5-dideoxy-5-{[4-(2-furyl)-2-pyrimidinyl]amino}-L-iditol Structure
Systematic / IUPAC Name: 1-[(3S,3aR,6S,6aR)-3-[[4-(Furan-2-yl)pyrimidin-2-yl]amino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]-3-(4-acetylphenyl)urea
ID: Reference10537
Other Names: NAT6-320264
Formula: C23H23N5O5
Spectral Data
2-{[(4-Acetylphenyl)carbamoyl]amino}-1,4:3,6-dianhydro-2,5-dideoxy-5-{[4-(2-furyl)-2-pyrimidinyl]amino}-L-iditol 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 | 2 |
| No. of Spectra | 3583 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 6/11/2021 11:50:24 AM |
Identificators
| InChI | InChI=1S/C23H23N5O5/c1-13(29)14-4-6-15(7-5-14)25-23(30)28-18-12-33-20-17(11-32-21(18)20)27-22-24-9-8-16(26-22)19-3-2-10-31-19/h2-10,17-18,20-21H,11-12H2,1H3,(H,24,26,27)(H2,25,28,30)/t17-,18-,20+,21+/m0/s1 |
| InChI Key | RZEJVEXGWKJYSM-FMWKFLBASA-N |
| Canonical SMILES | CC(=O)C1=CC=C(C=C1)NC(=O)NC2COC3C2OCC3NC4=NC=CC(=N4)C5=CC=CO5 |
| CAS | |
| Splash | |
| Other Names | NAT6-320264 |