8HE
Summary
| Name: | 4-(4-cyanophenyl)benzenesulfonamide |
| Formula: | C13 H10 N2 O2 S |
| Formal charge: | 0 |
| Formula weight: | 258.296 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 4-(4-cyanophenyl)benzenesulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H10N2O2S/c14-9-10-1-3-11(4-2-10)12-5-7-13(8-6-12)18(15,16)17/h1-8H,(H2,15,16,17) |
| InChIKey | InChI | 1.03 | LPESBVCEXRGQGA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[S](=O)(=O)c1ccc(cc1)c2ccc(cc2)C#N |
| SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1ccc(cc1)c2ccc(cc2)C#N |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1C#N)c2ccc(cc2)S(=O)(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1C#N)c2ccc(cc2)S(=O)(=O)N |
