QA9
Summary
| Name: | 1-(4-aminophenyl)sulfonylguanidine |
| Formula: | C7 H10 N4 O2 S |
| Formal charge: | 0 |
| Formula weight: | 214.245 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 3.1.0.0 | 1-(4-aminophenyl)sulfonylguanidine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C7H10N4O2S/c8-5-1-3-6(4-2-5)14(12,13)11-7(9)10/h1-4H,8H2,(H4,9,10,11) |
| InChIKey | InChI | 1.06 | BRBKOPJOKNSWSG-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=N)N[S](=O)(=O)c1ccc(N)cc1 |
| SMILES | CACTVS | 3.385 | NC(=N)N[S](=O)(=O)c1ccc(N)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | [H]/N=C(/N)\NS(=O)(=O)c1ccc(cc1)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1cc(ccc1N)S(=O)(=O)NC(=N)N |
