N-[(1R,9S)-11-(4-Biphenylylcarbonyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]-2-thiophenecarboxamide
12864
Reference
N-[(1R,9S)-11-(4-Biphenylylcarbonyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]-2-thiophenecarboxamide Structure
Systematic / IUPAC Name: N-[(1R,9S)-6-Oxo-11-(4-phenylbenzoyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]thiophene-2-carboxamide
ID: Reference12864
Other Names: NAT11-291852
Formula: C29H25N3O3S
Spectral Data
N-[(1R,9S)-11-(4-Biphenylylcarbonyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]-2-thiophenecarboxamide 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 | 1387 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 11/7/2023 12:32:15 PM |
Identificators
| InChI | InChI=1S/C29H25N3O3S/c33-27(26-7-4-14-36-26)30-24-12-13-25-23-15-19(17-32(25)29(24)35)16-31(18-23)28(34)22-10-8-21(9-11-22)20-5-2-1-3-6-20/h1-14,19,23H,15-18H2,(H,30,33)/t19-,23+/m0/s1 |
| InChI Key | HZEPBVKJJRZPJX-WMZHIEFXSA-N |
| Canonical SMILES | C1C2CN(CC1C3=CC=C(C(=O)N3C2)NC(=O)C4=CC=CS4)C(=O)C5=CC=C(C=C5)C6=CC=CC=C6 |
| CAS | |
| Splash | |
| Other Names | NAT11-291852 |