Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)C(N)=O |
InChI | InChI | 1.06 | InChI=1S/C12H17N3O3S/c1-14-6-8-15(9-7-14)19(17,18)11-4-2-10(3-5-11)12(13)16/h2-5H,6-9H2,1H3,(H2,13,16) |
InChIKey | InChI | 1.06 | DGYBGNBRDCUNEP-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CN1CCN(CC1)[S](=O)(=O)c2ccc(cc2)C(N)=O |
SMILES | CACTVS | 3.385 | CN1CCN(CC1)[S](=O)(=O)c2ccc(cc2)C(N)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN1CCN(CC1)S(=O)(=O)c2ccc(cc2)C(=O)N |
SMILES | OpenEye OEToolkits | 2.0.7 | CN1CCN(CC1)S(=O)(=O)c2ccc(cc2)C(=O)N |