(1R,9R)-5-[(Benzylsulfonyl)amino]-N-(4-methoxyphenyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
13222
Reference
(1R,9R)-5-[(Benzylsulfonyl)amino]-N-(4-methoxyphenyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide Structure
Systematic / IUPAC Name: (1R,9R)-5-(Benzylsulfonylamino)-N-(4-methoxyphenyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
ID: Reference13222
Other Names: NAT11-292331
Formula: C26H28N4O5S
Spectral Data
(1R,9R)-5-[(Benzylsulfonyl)amino]-N-(4-methoxyphenyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide 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 | 5430 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 7/11/2024 9:09:48 AM |
Identificators
| InChI | InChI=1S/C26H28N4O5S/c1-35-22-9-7-21(8-10-22)27-26(32)29-14-19-13-20(16-29)24-12-11-23(25(31)30(24)15-19)28-36(33,34)17-18-5-3-2-4-6-18/h2-12,19-20,28H,13-17H2,1H3,(H,27,32)/t19-,20+/m0/s1 |
| InChI Key | PZKQJIZVVLCFIY-VQTJNVASSA-N |
| Canonical SMILES | COC1=CC=C(C=C1)NC(=O)N2CC3CC(C2)C4=CC=C(C(=O)N4C3)NS(=O)(=O)CC5=CC=CC=C5 |
| CAS | |
| Splash | |
| Other Names | NAT11-292331 |