![3-{2-[(p-Chlorophenyl)thio]acetamido}-2-thiophenecarboxamide](/api/spectrum/9XMLK4XfzZj/structure.png?h=300&w=458 "3-{2-[(p-Chlorophenyl)thio]acetamido}-2-thiophenecarboxamide")
| SpectraBase Compound ID | If8BPCZXJJA |
|---|---|
| InChI | InChI=1S/C13H11ClN2O2S2/c14-8-1-3-9(4-2-8)20-7-11(17)16-10-5-6-19-12(10)13(15)18/h1-6H,7H2,(H2,15,18)(H,16,17) |
| InChIKey | PJQPBDARTWFTMJ-UHFFFAOYSA-N |
| Mol Weight | 326.82 g/mol |
| Molecular Formula | C13H11ClN2O2S2 |
| Exact Mass | 325.995048 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9XMLK4XfzZj |
|---|---|
| Name | 3-{2-[(p-Chlorophenyl)thio]acetamido}-2-thiophenecarboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 325.995047648 u |
| Formula | C13H11ClN2O2S2 |
| InChI | InChI=1S/C13H11ClN2O2S2/c14-8-1-3-9(4-2-8)20-7-11(17)16-10-5-6-19-12(10)13(15)18/h1-6H,7H2,(H2,15,18)(H,16,17) |
| InChIKey | PJQPBDARTWFTMJ-UHFFFAOYSA-N |
| Molecular Weight | 326.816 g/mol |
| SMILES | N(C(CSC1=CC=C(C=C1)Cl)=O)C=1C=CSC1C(N)=O |