![butanamide, N-(2-phenylethyl)-4-[(2-thienylsulfonyl)amino]-](/api/spectrum/ByFhJwtBCzG/structure.png?h=300&w=458 "butanamide, N-(2-phenylethyl)-4-[(2-thienylsulfonyl)amino]-")
| SpectraBase Compound ID | 3iggIAyB8m0 |
|---|---|
| InChI | InChI=1S/C16H20N2O3S2/c19-15(17-12-10-14-6-2-1-3-7-14)8-4-11-18-23(20,21)16-9-5-13-22-16/h1-3,5-7,9,13,18H,4,8,10-12H2,(H,17,19) |
| InChIKey | OELJCAVYYKFWOY-UHFFFAOYSA-N |
| Mol Weight | 352.47 g/mol |
| Molecular Formula | C16H20N2O3S2 |
| Exact Mass | 352.091535 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ByFhJwtBCzG |
|---|---|
| Name | Butanamide, N-(2-phenylethyl)-4-[(2-thienylsulfonyl)amino]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 352.091534857 u |
| Formula | C16H20N2O3S2 |
| InChI | InChI=1S/C16H20N2O3S2/c19-15(17-12-10-14-6-2-1-3-7-14)8-4-11-18-23(20,21)16-9-5-13-22-16/h1-3,5-7,9,13,18H,4,8,10-12H2,(H,17,19) |
| InChIKey | OELJCAVYYKFWOY-UHFFFAOYSA-N |
| SMILES | N(C(CCCNS(C=1SC=CC1)(=O)=O)=O)CCC1=CC=CC=C1 |