![2-[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-(2-methylphenyl)acetamide](/api/spectrum/7qdBVBmLJxo/structure.png?h=300&w=458 "2-[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-(2-methylphenyl)acetamide")
| SpectraBase Compound ID | 1YAIsgNx3K6 |
|---|---|
| InChI | InChI=1S/C17H17N3O2S/c1-11-5-3-4-6-13(11)18-16(21)10-23-17-19-14-8-7-12(22-2)9-15(14)20-17/h3-9H,10H2,1-2H3,(H,18,21)(H,19,20) |
| InChIKey | JKUVLBAAAGXCKF-UHFFFAOYSA-N |
| Mol Weight | 327.4 g/mol |
| Molecular Formula | C17H17N3O2S |
| Exact Mass | 327.104148 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7qdBVBmLJxo |
|---|---|
| Name | 2-[(5-Methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-(2-methylphenyl)acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 327.104147971 u |
| Formula | C17H17N3O2S |
| InChI | InChI=1S/C17H17N3O2S/c1-11-5-3-4-6-13(11)18-16(21)10-23-17-19-14-8-7-12(22-2)9-15(14)20-17/h3-9H,10H2,1-2H3,(H,18,21)(H,19,20) |
| InChIKey | JKUVLBAAAGXCKF-UHFFFAOYSA-N |
| SMILES | N1C2=CC=C(C=C2N=C1SCC(NC1=C(C)C=CC=C1)=O)OC |