LBQ
Summary
| Name: | 4-(furan-2-ylmethylamino)benzenesulfonamide |
| Formula: | C11 H12 N2 O3 S |
| Formal charge: | 0 |
| Formula weight: | 252.29 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-(furan-2-ylmethylamino)benzenesulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C11H12N2O3S/c12-17(14,15)11-5-3-9(4-6-11)13-8-10-2-1-7-16-10/h1-7,13H,8H2,(H2,12,14,15) |
| InChIKey | InChI | 1.03 | GTFXUNQMJHDIRE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[S](=O)(=O)c1ccc(NCc2occc2)cc1 |
| SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1ccc(NCc2occc2)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(oc1)CNc2ccc(cc2)S(=O)(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(oc1)CNc2ccc(cc2)S(=O)(=O)N |
