SpectraBase Compound ID | dK0FIUNVzi |
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InChI | InChI=1S/C23H27N3O3S/c1-16-8-9-18(14-17(16)2)22(28)25-20(15-19-6-4-13-30-19)23(29)24-10-5-12-26-11-3-7-21(26)27/h4,6,8-9,13-15H,3,5,7,10-12H2,1-2H3,(H,24,29)(H,25,28)/b20-15- |
InChIKey | LESQKFSGZLDWAC-HKWRFOASSA-N |
Mol Weight | 425.55 g/mol |
Molecular Formula | C23H27N3O3S |
Exact Mass | 425.177313 g/mol |
SpectraBase Spectrum ID | Dr7cIBjyUWJ |
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Name | benzamide, 3,4-dimethyl-N-[(Z)-1-[[[3-(2-oxo-1-pyrrolidinyl)propyl]amino]carbonyl]-2-(2-thienyl)ethenyl]- |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 425.177312912 u |
Formula | C23H27N3O3S |
InChI | InChI=1S/C23H27N3O3S/c1-16-8-9-18(14-17(16)2)22(28)25-20(15-19-6-4-13-30-19)23(29)24-10-5-12-26-11-3-7-21(26)27/h4,6,8-9,13-15H,3,5,7,10-12H2,1-2H3,(H,24,29)(H,25,28)/b20-15- |
InChIKey | LESQKFSGZLDWAC-HKWRFOASSA-N |
Molecular Weight | 425.547 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2017_14981 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/10311661; Lab Info: FNG; Lab Number: FNG-0000251 |