![2-{[p-(2-chloro-6-fluorostyryl)benzyl]thio}-3-(2,4-difluorophenyl)-4(3H)-quinazolinone](/api/spectrum/GkiRQBxRcFx/structure.png?h=300&w=458 "2-{[p-(2-chloro-6-fluorostyryl)benzyl]thio}-3-(2,4-difluorophenyl)-4(3H)-quinazolinone")
| SpectraBase Compound ID | BI2fO7bsPot |
|---|---|
| InChI | InChI=1S/C29H18ClF3N2OS/c30-23-5-3-6-24(32)21(23)14-12-18-8-10-19(11-9-18)17-37-29-34-26-7-2-1-4-22(26)28(36)35(29)27-15-13-20(31)16-25(27)33/h1-16H,17H2 |
| InChIKey | VWUUFGSCBFKKMK-UHFFFAOYSA-N |
| Mol Weight | 534.98 g/mol |
| Molecular Formula | C29H18ClF3N2OS |
| Exact Mass | 534.078047 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GkiRQBxRcFx |
|---|---|
| Name | 2-{[p-(2-chloro-6-fluorostyryl)benzyl]thio}-3-(2,4-difluorophenyl)-4(3H)-quinazolinone |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H18ClF3N2OS |
| InChI | InChI=1S/C29H18ClF3N2OS/c30-23-5-3-6-24(32)21(23)14-12-18-8-10-19(11-9-18)17-37-29-34-26-7-2-1-4-22(26)28(36)35(29)27-15-13-20(31)16-25(27)33/h1-16H,17H2 |
| InChIKey | VWUUFGSCBFKKMK-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 48039M |
| Solvent | CDCl3 |