![N-[(1S)-2-Hydroxy-1-{(1R,2S)-2-{(S)-N-methylphenylsulfonimidoyl}methylcycloheptyl}ethyl]-2-methylpropane-2-sulfonamide](/api/spectrum/2LY8d8sOJpR/structure.png?h=300&w=458 "N-[(1S)-2-Hydroxy-1-{(1R,2S)-2-{(S)-N-methylphenylsulfonimidoyl}methylcycloheptyl}ethyl]-2-methylpropane-2-sulfonamide")
| SpectraBase Compound ID | 2Adx4guKFhu |
|---|---|
| InChI | InChI=1S/C21H36N2O4S2/c1-21(2,3)29(26,27)23-20(15-24)19-14-10-5-7-11-17(19)16-28(25,22-4)18-12-8-6-9-13-18/h6,8-9,12-13,17,19-20,23-24H,5,7,10-11,14-16H2,1-4H3/t17?,19?,20-,28?/m1/s1 |
| InChIKey | USIOXWVAWQKFQY-ILDMOBEGSA-N |
| Mol Weight | 444.6 g/mol |
| Molecular Formula | C21H36N2O4S2 |
| Exact Mass | 444.21165 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2LY8d8sOJpR |
|---|---|
| Name | N-[(1S)-2-Hydroxy-1-{(1R,2S)-2-{(S)-N-methylphenylsulfonimidoyl}methylcycloheptyl}ethyl]-2-methylpropane-2-sulfonamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H36N2O4S2 |
| InChI | InChI=1S/C21H36N2O4S2/c1-21(2,3)29(26,27)23-20(15-24)19-14-10-5-7-11-17(19)16-28(25,22-4)18-12-8-6-9-13-18/h6,8-9,12-13,17,19-20,23-24H,5,7,10-11,14-16H2,1-4H3/t17?,19?,20-,28?/m1/s1 |
| InChIKey | USIOXWVAWQKFQY-ILDMOBEGSA-N |
| Molecular Weight | 444.649 g/mol |
| SMILES | N(S(C(C)(C)C)(=O)=O)[C@](CO)(C1C(CS(=NC)(=O)c2ccccc2)CCCCC1)[H] |
| SPLASH | splash10-0a4i-5900000000-736e1ff4b22339a36a22 |
| Source of Spectrum | U1-2011-6002-22 |
| Wiley ID | 1713410 |