SpectraBase Compound ID | GV0Ou5zrzy |
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InChI | InChI=1S/C30H31ClN4O4/c1-20-14-15-23(17-21(20)2)33-28(37)19-35-26-12-6-4-10-24(26)29(38)34(30(35)39)16-8-7-13-27(36)32-18-22-9-3-5-11-25(22)31/h3-6,9-12,14-15,17H,7-8,13,16,18-19H2,1-2H3,(H,32,36)(H,33,37) |
InChIKey | GJBZXPNYHRGLBD-UHFFFAOYSA-N |
Mol Weight | 547.06 g/mol |
Molecular Formula | C30H31ClN4O4 |
Exact Mass | 546.203383 g/mol |
SpectraBase Spectrum ID | BwLC7VEE2ym |
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Name | N-(2-chlorobenzyl)-5-(1-[2-(3,4-dimethylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)pentanamide |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 546.203383190 u |
Formula | C30H31ClN4O4 |
InChI | InChI=1S/C30H31ClN4O4/c1-20-14-15-23(17-21(20)2)33-28(37)19-35-26-12-6-4-10-24(26)29(38)34(30(35)39)16-8-7-13-27(36)32-18-22-9-3-5-11-25(22)31/h3-6,9-12,14-15,17H,7-8,13,16,18-19H2,1-2H3,(H,32,36)(H,33,37) |
InChIKey | GJBZXPNYHRGLBD-UHFFFAOYSA-N |
Molecular Weight | 547.055 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_7450 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/13218239 |