![5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(2-thienylmethyl)-2-furamide](/api/spectrum/EvFASQEoERU/structure.png?h=300&w=458 "5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(2-thienylmethyl)-2-furamide")
| SpectraBase Compound ID | 9mK4mz2zdXd |
|---|---|
| InChI | InChI=1S/C16H17N3O2S/c1-11-8-12(2)19(18-11)10-13-5-6-15(21-13)16(20)17-9-14-4-3-7-22-14/h3-8H,9-10H2,1-2H3,(H,17,20) |
| InChIKey | MKEBVKQVKRPUSZ-UHFFFAOYSA-N |
| Mol Weight | 315.39 g/mol |
| Molecular Formula | C16H17N3O2S |
| Exact Mass | 315.104148 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EvFASQEoERU |
|---|---|
| Name | 5-[(3,5-Dimethyl-1H-pyrazol-1-yl)methyl]-N-(2-thienylmethyl)-2-furamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.104147971 u |
| Formula | C16H17N3O2S |
| InChI | InChI=1S/C16H17N3O2S/c1-11-8-12(2)19(18-11)10-13-5-6-15(21-13)16(20)17-9-14-4-3-7-22-14/h3-8H,9-10H2,1-2H3,(H,17,20) |
| InChIKey | MKEBVKQVKRPUSZ-UHFFFAOYSA-N |
| SMILES | N(CC=1SC=CC1)C(C=1OC(CN2N=C(C)C=C2C)=CC1)=O |