![N-{{p-[5-(2-thienyl)-3-(trifluoromethyl)pyrazol-1-yl]phenyl}sulfonyl}thiocarbazimidic acid, methyl ester](/api/spectrum/A0CYdp29zhU/structure.png?h=300&w=458 "N-{{p-[5-(2-thienyl)-3-(trifluoromethyl)pyrazol-1-yl]phenyl}sulfonyl}thiocarbazimidic acid, methyl ester")
| SpectraBase Compound ID | B7qk6rGyocC |
|---|---|
| InChI | InChI=1S/C16H14F3N5O2S3/c1-27-15(21-20)23-29(25,26)11-6-4-10(5-7-11)24-12(13-3-2-8-28-13)9-14(22-24)16(17,18)19/h2-9H,20H2,1H3,(H,21,23) |
| InChIKey | CHPUNDGLIRWGFS-UHFFFAOYSA-N |
| Mol Weight | 461.5 g/mol |
| Molecular Formula | C16H14F3N5O2S3 |
| Exact Mass | 461.026173 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A0CYdp29zhU |
|---|---|
| Name | N-{{p-[5-(2-thienyl)-3-(trifluoromethyl)pyrazol-1-yl]phenyl}sulfonyl}thiocarbazimidic acid, methyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H14F3N5O2S3 |
| InChI | InChI=1S/C16H14F3N5O2S3/c1-27-15(21-20)23-29(25,26)11-6-4-10(5-7-11)24-12(13-3-2-8-28-13)9-14(22-24)16(17,18)19/h2-9H,20H2,1H3,(H,21,23) |
| InChIKey | CHPUNDGLIRWGFS-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 55870M |
| Solvent | Polysol |