72H
Summary
| Name: | 4-(3-quinolinyl)-benzenesulfonamide |
| Synonyms: | 4-(quinolin-3-yl)benzene-1-sulfonamide |
| Formula: | C15 H12 N2 O2 S |
| Formal charge: | 0 |
| Formula weight: | 284.333 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-(quinolin-3-yl)benzene-1-sulfonamide |
| OpenEye OEToolkits | 2.0.5 | 4-quinolin-3-ylbenzenesulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c2c1ccccc1ncc2c3ccc(S(=O)(=O)N)cc3 |
| InChI | InChI | 1.03 | InChI=1S/C15H12N2O2S/c16-20(18,19)14-7-5-11(6-8-14)13-9-12-3-1-2-4-15(12)17-10-13/h1-10H,(H2,16,18,19) |
| InChIKey | InChI | 1.03 | HGZKFXIUXSUJHM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[S](=O)(=O)c1ccc(cc1)c2cnc3ccccc3c2 |
| SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1ccc(cc1)c2cnc3ccccc3c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | c1ccc2c(c1)cc(cn2)c3ccc(cc3)S(=O)(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.5 | c1ccc2c(c1)cc(cn2)c3ccc(cc3)S(=O)(=O)N |
