![o-chloro-N-[4-(isopropylsulfonyl)-3-thienyl]benzamide](/api/spectrum/CUCQAqPhebq/structure.png?h=300&w=458 "o-chloro-N-[4-(isopropylsulfonyl)-3-thienyl]benzamide")
| SpectraBase Compound ID | 8XAMTy3vFz2 |
|---|---|
| InChI | InChI=1S/C14H14ClNO3S2/c1-9(2)21(18,19)13-8-20-7-12(13)16-14(17)10-5-3-4-6-11(10)15/h3-9H,1-2H3,(H,16,17) |
| InChIKey | RHLPZNWDJPGZRC-UHFFFAOYSA-N |
| Mol Weight | 343.84 g/mol |
| Molecular Formula | C14H14ClNO3S2 |
| Exact Mass | 343.010363 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CUCQAqPhebq |
|---|---|
| Name | o-Chloro-N-[4-(isopropylsulfonyl)-3-thienyl]benzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 343.010363360 u |
| Formula | C14H14ClNO3S2 |
| InChI | InChI=1S/C14H14ClNO3S2/c1-9(2)21(18,19)13-8-20-7-12(13)16-14(17)10-5-3-4-6-11(10)15/h3-9H,1-2H3,(H,16,17) |
| InChIKey | RHLPZNWDJPGZRC-UHFFFAOYSA-N |
| Molecular Weight | 343.843 g/mol |
| SMILES | N(C(C1=CC=CC=C1Cl)=O)C=1C(=CSC1)S(=O)(=O)C(C)C |