![N-(2-chlorobenzyl)-5-(1-[2-(4-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)pentanamide](/api/spectrum/6oR79CRBtRv/structure.png?h=300&w=458 "N-(2-chlorobenzyl)-5-(1-[2-(4-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)pentanamide")
| SpectraBase Compound ID | AComsjhsnVE |
|---|---|
| InChI | InChI=1S/C29H29ClN4O5/c1-39-22-15-13-21(14-16-22)32-27(36)19-34-25-11-5-3-9-23(25)28(37)33(29(34)38)17-7-6-12-26(35)31-18-20-8-2-4-10-24(20)30/h2-5,8-11,13-16H,6-7,12,17-19H2,1H3,(H,31,35)(H,32,36) |
| InChIKey | WICPWMVVMGHOKJ-UHFFFAOYSA-N |
| Mol Weight | 549.03 g/mol |
| Molecular Formula | C29H29ClN4O5 |
| Exact Mass | 548.182648 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 6oR79CRBtRv |
|---|---|
| Name | N-(2-chlorobenzyl)-5-(1-[2-(4-methoxyanilino)-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 | 548.182647745 u |
| Formula | C29H29ClN4O5 |
| InChI | InChI=1S/C29H29ClN4O5/c1-39-22-15-13-21(14-16-22)32-27(36)19-34-25-11-5-3-9-23(25)28(37)33(29(34)38)17-7-6-12-26(35)31-18-20-8-2-4-10-24(20)30/h2-5,8-11,13-16H,6-7,12,17-19H2,1H3,(H,31,35)(H,32,36) |
| InChIKey | WICPWMVVMGHOKJ-UHFFFAOYSA-N |
| Molecular Weight | 549.027 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_7448 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/13218235 |