SpectraBase Compound ID | IAxMfMK4el2 |
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InChI | InChI=1S/C22H33N5O3S/c1-6-26(7-2)19-8-9-20(15(3)14-19)23-22(28)18-10-12-27(13-11-18)31(29,30)21-16(4)24-25-17(21)5/h8-9,14,18H,6-7,10-13H2,1-5H3,(H,23,28)(H,24,25) |
InChIKey | FOOXECFANQGBQL-UHFFFAOYSA-N |
Mol Weight | 447.6 g/mol |
Molecular Formula | C22H33N5O3S |
Exact Mass | 447.230411 g/mol |
SpectraBase Spectrum ID | I1te6zIVf8o |
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Name | N-[4-(diethylamino)-2-methylphenyl]-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-4-piperidinecarboxamide |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 447.230411114 u |
Formula | C22H33N5O3S |
InChI | InChI=1S/C22H33N5O3S/c1-6-26(7-2)19-8-9-20(15(3)14-19)23-22(28)18-10-12-27(13-11-18)31(29,30)21-16(4)24-25-17(21)5/h8-9,14,18H,6-7,10-13H2,1-5H3,(H,23,28)(H,24,25) |
InChIKey | FOOXECFANQGBQL-UHFFFAOYSA-N |
Molecular Weight | 447.598 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_4590 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12309596 |