![2-[(2-Ethoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide](/api/spectrum/3mLLmxBfyzZ/structure.png?h=300&w=458 "2-[(2-Ethoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide")
| SpectraBase Compound ID | Ld3RkDG7M9D |
|---|---|
| InChI | InChI=1S/C18H20N2O3S/c1-2-23-13-9-5-3-7-11(13)17(22)20-18-15(16(19)21)12-8-4-6-10-14(12)24-18/h3,5,7,9H,2,4,6,8,10H2,1H3,(H2,19,21)(H,20,22) |
| InChIKey | BSPTZCLGDYMLBV-UHFFFAOYSA-N |
| Mol Weight | 344.43 g/mol |
| Molecular Formula | C18H20N2O3S |
| Exact Mass | 344.119464 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3mLLmxBfyzZ |
|---|---|
| Name | 2-[(2-Ethoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 344.119463683 u |
| Formula | C18H20N2O3S |
| InChI | InChI=1S/C18H20N2O3S/c1-2-23-13-9-5-3-7-11(13)17(22)20-18-15(16(19)21)12-8-4-6-10-14(12)24-18/h3,5,7,9H,2,4,6,8,10H2,1H3,(H2,19,21)(H,20,22) |
| InChIKey | BSPTZCLGDYMLBV-UHFFFAOYSA-N |
| Molecular Weight | 344.429 g/mol |
| SMILES | NC(C1=C(SC=2CCCCC12)NC(C1=C(OCC)C=CC=C1)=O)=O |