(1R,9R)-N-(3-Cyanophenyl)-6-oxo-5-(2-thienyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
12333
Reference
(1R,9R)-N-(3-Cyanophenyl)-6-oxo-5-(2-thienyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide Structure
Systematic / IUPAC Name: (1R,9R)-N-(3-Cyanophenyl)-6-oxo-5-thiophen-2-yl-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
ID: Reference12333
Other Names: NAT11-284077
Formula: C23H20N4O2S
Spectral Data
(1R,9R)-N-(3-Cyanophenyl)-6-oxo-5-(2-thienyl)-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 | 1 |
| No. of Spectra | 2289 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 3/6/2023 7:49:37 PM |
Identificators
| InChI | InChI=1S/C23H20N4O2S/c24-11-15-3-1-4-18(10-15)25-23(29)26-12-16-9-17(14-26)20-7-6-19(21-5-2-8-30-21)22(28)27(20)13-16/h1-8,10,16-17H,9,12-14H2,(H,25,29)/t16-,17+/m0/s1 |
| InChI Key | NGODYGMQKQLMFA-DLBZAZTESA-N |
| Canonical SMILES | C1C2CN(CC1C3=CC=C(C(=O)N3C2)C4=CC=CS4)C(=O)NC5=CC=CC(=C5)C#N |
| CAS | |
| Splash | |
| Other Names | NAT11-284077 |