![1-[3-(5-chloro-3-methylbezo[b]thien-2-yl)-1-methylpyrazol-5-yl]-3-isopropylurea](/api/spectrum/Dfh8MFTjxTL/structure.png?h=300&w=458 "1-[3-(5-chloro-3-methylbezo[b]thien-2-yl)-1-methylpyrazol-5-yl]-3-isopropylurea")
| SpectraBase Compound ID | 5y5XVMqdwIC |
|---|---|
| InChI | InChI=1S/C17H19ClN4OS/c1-9(2)19-17(23)20-15-8-13(21-22(15)4)16-10(3)12-7-11(18)5-6-14(12)24-16/h5-9H,1-4H3,(H2,19,20,23) |
| InChIKey | NFKFRUWITDBUGB-UHFFFAOYSA-N |
| Mol Weight | 362.88 g/mol |
| Molecular Formula | C17H19ClN4OS |
| Exact Mass | 362.09681 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dfh8MFTjxTL |
|---|---|
| Name | 1-[3-(5-chloro-3-methylbezo[b]thien-2-yl)-1-methylpyrazol-5-yl]-3-isopropylurea |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H19ClN4OS |
| InChI | InChI=1S/C17H19ClN4OS/c1-9(2)19-17(23)20-15-8-13(21-22(15)4)16-10(3)12-7-11(18)5-6-14(12)24-16/h5-9H,1-4H3,(H2,19,20,23) |
| InChIKey | NFKFRUWITDBUGB-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 59210M |
| Solvent | DMSO-d6 |