SpectraBase Compound ID | 51SFDnyEQpX |
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InChI | InChI=1S/C25H27ClN4O4/c26-20-11-5-1-7-17(20)15-27-23(32)16-30-21-12-6-4-10-19(21)24(33)29(25(30)34)14-13-22(31)28-18-8-2-3-9-18/h1,4-7,10-12,18H,2-3,8-9,13-16H2,(H,27,32)(H,28,31) |
InChIKey | HGDVOYTZGUSVJX-UHFFFAOYSA-N |
Mol Weight | 482.97 g/mol |
Molecular Formula | C25H27ClN4O4 |
Exact Mass | 482.172083 g/mol |
SpectraBase Spectrum ID | AlKjlAVaSdc |
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Name | 3-(1-{2-[(2-chlorobenzyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)-N-cyclopentylpropanamide |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 482.172083061 u |
Formula | C25H27ClN4O4 |
InChI | InChI=1S/C25H27ClN4O4/c26-20-11-5-1-7-17(20)15-27-23(32)16-30-21-12-6-4-10-19(21)24(33)29(25(30)34)14-13-22(31)28-18-8-2-3-9-18/h1,4-7,10-12,18H,2-3,8-9,13-16H2,(H,27,32)(H,28,31) |
InChIKey | HGDVOYTZGUSVJX-UHFFFAOYSA-N |
Molecular Weight | 482.968 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_6053 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/12328088 |