Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(N1CCC(NS(=O)(=O)CC)CC1)COc2ccc(Cl)cc2Cl |
InChI | InChI | 1.03 | InChI=1S/C15H20Cl2N2O4S/c1-2-24(21,22)18-12-5-7-19(8-6-12)15(20)10-23-14-4-3-11(16)9-13(14)17/h3-4,9,12,18H,2,5-8,10H2,1H3 |
InChIKey | InChI | 1.03 | XSFRSTBQVCUTJX-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC[S](=O)(=O)NC1CCN(CC1)C(=O)COc2ccc(Cl)cc2Cl |
SMILES | CACTVS | 3.385 | CC[S](=O)(=O)NC1CCN(CC1)C(=O)COc2ccc(Cl)cc2Cl |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCS(=O)(=O)NC1CCN(CC1)C(=O)COc2ccc(cc2Cl)Cl |
SMILES | OpenEye OEToolkits | 1.7.6 | CCS(=O)(=O)NC1CCN(CC1)C(=O)COc2ccc(cc2Cl)Cl |