![1-(3-Chloro-4-fluorophenyl)-3-[(1,2,3-thiadiazol-4-yl)carbonyl]urea](/api/spectrum/F0rEy8d5PhF/structure.png?h=300&w=458 "1-(3-Chloro-4-fluorophenyl)-3-[(1,2,3-thiadiazol-4-yl)carbonyl]urea")
| SpectraBase Compound ID | KeSytldYeUC |
|---|---|
| InChI | InChI=1S/C10H6ClFN4O2S/c11-6-3-5(1-2-7(6)12)13-10(18)14-9(17)8-4-19-16-15-8/h1-4H,(H2,13,14,17,18) |
| InChIKey | CJIPCVFVARJKKI-UHFFFAOYSA-N |
| Mol Weight | 300.7 g/mol |
| Molecular Formula | C10H6ClFN4O2S |
| Exact Mass | 299.988402 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F0rEy8d5PhF |
|---|---|
| Name | 1-(3-Chloro-4-fluorophenyl)-3-[(1,2,3-thiadiazol-4-yl)carbonyl]urea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 299.988402484 u |
| Formula | C10H6ClFN4O2S |
| InChI | InChI=1S/C10H6ClFN4O2S/c11-6-3-5(1-2-7(6)12)13-10(18)14-9(17)8-4-19-16-15-8/h1-4H,(H2,13,14,17,18) |
| InChIKey | CJIPCVFVARJKKI-UHFFFAOYSA-N |
| Molecular Weight | 300.695 g/mol |
| SMILES | N(C1=CC=C(C(=C1)Cl)F)C(NC(C=1N=NSC1)=O)=O |