| SpectraBase Compound ID | EZw079QmgHI |
|---|---|
| InChI | InChI=1S/C29H25F4N3O4S/c1-39-21-11-6-16(14-22(21)40-2)12-13-35-27(38)23-24(34)26(25(37)17-7-9-19(30)10-8-17)41-28(23)36-20-5-3-4-18(15-20)29(31,32)33/h3-11,14-15,36H,12-13,34H2,1-2H3,(H,35,38) |
| InChIKey | DHZRFWZOECWSCS-UHFFFAOYSA-N |
| Mol Weight | 587.59 g/mol |
| Molecular Formula | C29H25F4N3O4S |
| Exact Mass | 587.15019 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ez4u9kkhmjP |
|---|---|
| Name | 4-amino-N-(3,4-dimethoxyphenethyl)-5-(p-fluorobenzoyl)-2-(a,a,a-trifluoro-m-toluidino)-3-thiophenecarboxamide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H25F4N3O4S |
| InChI | InChI=1S/C29H25F4N3O4S/c1-39-21-11-6-16(14-22(21)40-2)12-13-35-27(38)23-24(34)26(25(37)17-7-9-19(30)10-8-17)41-28(23)36-20-5-3-4-18(15-20)29(31,32)33/h3-11,14-15,36H,12-13,34H2,1-2H3,(H,35,38) |
| InChIKey | DHZRFWZOECWSCS-UHFFFAOYSA-N |
| Instrument Name | Varian A-60 |
| Sadtler NMR Number | 22508M |
| Solvent | CDCl3 |