| SpectraBase Compound ID | F1CP54mavD6 |
|---|---|
| InChI | InChI=1S/C11H12N4OS/c1-2-9-14-15-11(17-9)13-10(16)12-8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H2,12,13,15,16) |
| InChIKey | NTLONFCJXBEVPY-UHFFFAOYSA-N |
| Mol Weight | 248.3 g/mol |
| Molecular Formula | C11H12N4OS |
| Exact Mass | 248.073182 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8jOl0YBTrcL |
|---|---|
| Name | 1-(5-Ethyl-1,3,4-thiadiazol-2-yl)-3-phenylurea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.073182195 u |
| Formula | C11H12N4OS |
| InChI | InChI=1S/C11H12N4OS/c1-2-9-14-15-11(17-9)13-10(16)12-8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H2,12,13,15,16) |
| InChIKey | NTLONFCJXBEVPY-UHFFFAOYSA-N |
| Molecular Weight | 248.304 g/mol |
| SMILES | C=1(SC(CC)=NN1)NC(NC1=CC=CC=C1)=O |