N-[(1R,9R)-6-Oxo-11-(2-thienylsulfonyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]-2-pyrazinecarboxamide
13096
Reference
N-[(1R,9R)-6-Oxo-11-(2-thienylsulfonyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]-2-pyrazinecarboxamide Structure
Systematic / IUPAC Name: N-[(1R,9R)-6-Oxo-11-thiophen-2-ylsulfonyl-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]pyrazine-2-carboxamide
ID: Reference13096
Other Names: NAT11-276211
Formula: C20H19N5O4S2
Spectral Data
N-[(1R,9R)-6-Oxo-11-(2-thienylsulfonyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]-2-pyrazinecarboxamide 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 | 940 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 4/9/2024 2:24:21 PM |
Identificators
| InChI | InChI=1S/C20H19N5O4S2/c26-19(16-9-21-5-6-22-16)23-15-3-4-17-14-8-13(11-25(17)20(15)27)10-24(12-14)31(28,29)18-2-1-7-30-18/h1-7,9,13-14H,8,10-12H2,(H,23,26)/t13-,14+/m0/s1 |
| InChI Key | ULJILNHQQKAQOX-UONOGXRCSA-N |
| Canonical SMILES | C1C2CN(CC1C3=CC=C(C(=O)N3C2)NC(=O)C4=NC=CN=C4)S(=O)(=O)C5=CC=CS5 |
| CAS | |
| Splash | |
| Other Names | NAT11-276211 |