Nα-{[(2S)-4-[4-(Dimethylamino)benzoyl]-1-(methylsulfonyl)-2-piperazinyl]carbonyl}-D-tryptophanamide
10257
Reference
Nα-{[(2S)-4-[4-(Dimethylamino)benzoyl]-1-(methylsulfonyl)-2-piperazinyl]carbonyl}-D-tryptophanamide Structure
Systematic / IUPAC Name: (2S)-N-[(2R)-1-Amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-4-[4-(dimethylamino)benzoyl]-1-methylsulfonylpiperazine-2-carboxamide
ID: Reference10257
Other Names: NAT9-312800
Formula: C26H32N6O5S
Spectral Data
Nα-{[(2S)-4-[4-(Dimethylamino)benzoyl]-1-(methylsulfonyl)-2-piperazinyl]carbonyl}-D-tryptophanamide 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 | 2439 |
| Tandem Spectra | MS1, MS2, MS3, MS4, MS5, MS6 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 2/26/2021 1:06:03 PM |
Identificators
| InChI | InChI=1S/C26H32N6O5S/c1-30(2)19-10-8-17(9-11-19)26(35)31-12-13-32(38(3,36)37)23(16-31)25(34)29-22(24(27)33)14-18-15-28-21-7-5-4-6-20(18)21/h4-11,15,22-23,28H,12-14,16H2,1-3H3,(H2,27,33)(H,29,34)/t22-,23+/m1/s1 |
| InChI Key | HWXQLWKXQXAHLL-PKTZIBPZSA-N |
| Canonical SMILES | CN(C)C1=CC=C(C=C1)C(=O)N2CCN(C(C2)C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)N)S(=O)(=O)C |
| CAS | |
| Splash | |
| Other Names | NAT9-312800 |