![Methyl 3-{[(5-methyl-2-thienyl)carbonyl]amino}-2-thiophenecarboxylate](/api/spectrum/6372kPbFepu/structure.png?h=300&w=458 "Methyl 3-{[(5-methyl-2-thienyl)carbonyl]amino}-2-thiophenecarboxylate")
| SpectraBase Compound ID | FrCbXxsO9qW |
|---|---|
| InChI | InChI=1S/C12H11NO3S2/c1-7-3-4-9(18-7)11(14)13-8-5-6-17-10(8)12(15)16-2/h3-6H,1-2H3,(H,13,14) |
| InChIKey | YXQVGFLABKSHEG-UHFFFAOYSA-N |
| Mol Weight | 281.34 g/mol |
| Molecular Formula | C12H11NO3S2 |
| Exact Mass | 281.018036 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6372kPbFepu |
|---|---|
| Name | Methyl 3-{[(5-methyl-2-thienyl)carbonyl]amino}-2-thiophenecarboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.018035563 u |
| Formula | C12H11NO3S2 |
| InChI | InChI=1S/C12H11NO3S2/c1-7-3-4-9(18-7)11(14)13-8-5-6-17-10(8)12(15)16-2/h3-6H,1-2H3,(H,13,14) |
| InChIKey | YXQVGFLABKSHEG-UHFFFAOYSA-N |
| Molecular Weight | 281.344 g/mol |
| SMILES | N(C1=C(C(=O)OC)SC=C1)C(C=1SC(C)=CC1)=O |