N-{4-[({(1S,4S,6S)-6-Isopropyl-3-methyl-4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-2-cyclohexen-1-yl}methyl)sulfamoyl]phenyl}acetamide
10473
Reference
N-{4-[({(1S,4S,6S)-6-Isopropyl-3-methyl-4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-2-cyclohexen-1-yl}methyl)sulfamoyl]phenyl}acetamide Structure
Systematic / IUPAC Name: N-[4-[[(1S,4S,6S)-3-Methyl-4-(2-oxo-2-pyrrolidin-1-ylethyl)-6-propan-2-ylcyclohex-2-en-1-yl]methylsulfamoyl]phenyl]acetamide
ID: Reference10473
Other Names: NAT28-406192
Formula: C25H37N3O4S
Spectral Data
N-{4-[({(1S,4S,6S)-6-Isopropyl-3-methyl-4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-2-cyclohexen-1-yl}methyl)sulfamoyl]phenyl}acetamide 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 | 4954 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 5/21/2021 12:11:22 PM |
Identificators
| InChI | InChI=1S/C25H37N3O4S/c1-17(2)24-14-20(15-25(30)28-11-5-6-12-28)18(3)13-21(24)16-26-33(31,32)23-9-7-22(8-10-23)27-19(4)29/h7-10,13,17,20-21,24,26H,5-6,11-12,14-16H2,1-4H3,(H,27,29)/t20-,21-,24-/m0/s1 |
| InChI Key | QAIYEVAVBCFCLR-HFMPRLQTSA-N |
| Canonical SMILES | CC1=CC(C(CC1CC(=O)N2CCCC2)C(C)C)CNS(=O)(=O)C3=CC=C(C=C3)NC(=O)C |
| CAS | |
| Splash | |
| Other Names | NAT28-406192 |