Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(Nc1ccc(cc1)S(=O)(=O)N)NC2CCCC2 |
SMILES_CANONICAL | CACTVS | 3.370 | N[S](=O)(=O)c1ccc(NC(=O)NC2CCCC2)cc1 |
SMILES | CACTVS | 3.370 | N[S](=O)(=O)c1ccc(NC(=O)NC2CCCC2)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1cc(ccc1NC(=O)NC2CCCC2)S(=O)(=O)N |
SMILES | OpenEye OEToolkits | 1.7.0 | c1cc(ccc1NC(=O)NC2CCCC2)S(=O)(=O)N |
InChI | InChI | 1.03 | InChI=1S/C12H17N3O3S/c13-19(17,18)11-7-5-10(6-8-11)15-12(16)14-9-3-1-2-4-9/h5-9H,1-4H2,(H2,13,17,18)(H2,14,15,16) |
InChIKey | InChI | 1.03 | QRZYENXYGGOPSS-UHFFFAOYSA-N |