SpectraBase Compound ID | 58yd6egLSmP |
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InChI | InChI=1S/C25H27ClN4O5/c1-35-21-11-10-17(14-19(21)26)28-23(32)15-30-20-9-5-4-8-18(20)24(33)29(25(30)34)13-12-22(31)27-16-6-2-3-7-16/h4-5,8-11,14,16H,2-3,6-7,12-13,15H2,1H3,(H,27,31)(H,28,32) |
InChIKey | DVRYOJIVSUCOQE-UHFFFAOYSA-N |
Mol Weight | 498.97 g/mol |
Molecular Formula | C25H27ClN4O5 |
Exact Mass | 498.166998 g/mol |
SpectraBase Spectrum ID | GKy7D1PfO4z |
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Name | 3-(1-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-N-cyclopentylpropanamide |
Copyright | Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 498.166997680 u |
Formula | C25H27ClN4O5 |
InChI | InChI=1S/C25H27ClN4O5/c1-35-21-11-10-17(14-19(21)26)28-23(32)15-30-20-9-5-4-8-18(20)24(33)29(25(30)34)13-12-22(31)27-16-6-2-3-7-16/h4-5,8-11,14,16H,2-3,6-7,12-13,15H2,1H3,(H,27,31)(H,28,32) |
InChIKey | DVRYOJIVSUCOQE-UHFFFAOYSA-N |
Molecular Weight | 498.967 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_6057 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12328092 |