![2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(4-bromophenyl)acetamide](/api/spectrum/J4jvxXhk7hS/structure.png?h=300&w=458 "2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(4-bromophenyl)acetamide")
| SpectraBase Compound ID | I5qEzPxXQBx |
|---|---|
| InChI | InChI=1S/C10H9BrN4OS2/c11-6-1-3-7(4-2-6)13-8(16)5-17-10-15-14-9(12)18-10/h1-4H,5H2,(H2,12,14)(H,13,16) |
| InChIKey | UGHQPVZOXAOMQT-UHFFFAOYSA-N |
| Mol Weight | 345.23 g/mol |
| Molecular Formula | C10H9BrN4OS2 |
| Exact Mass | 343.940116 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J4jvxXhk7hS |
|---|---|
| Name | 2-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(4-bromophenyl)acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 343.940116273 u |
| Formula | C10H9BrN4OS2 |
| InChI | InChI=1S/C10H9BrN4OS2/c11-6-1-3-7(4-2-6)13-8(16)5-17-10-15-14-9(12)18-10/h1-4H,5H2,(H2,12,14)(H,13,16) |
| InChIKey | UGHQPVZOXAOMQT-UHFFFAOYSA-N |
| SMILES | N(C(CSC=1SC(=NN1)N)=O)C1=CC=C(C=C1)Br |