Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=S(=O)(c1ccccc1)NCCSc2cc(F)c(OCC(=O)N)c(F)c2 |
SMILES_CANONICAL | CACTVS | 3.370 | NC(=O)COc1c(F)cc(SCCN[S](=O)(=O)c2ccccc2)cc1F |
SMILES | CACTVS | 3.370 | NC(=O)COc1c(F)cc(SCCN[S](=O)(=O)c2ccccc2)cc1F |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)S(=O)(=O)NCCSc2cc(c(c(c2)F)OCC(=O)N)F |
SMILES | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)S(=O)(=O)NCCSc2cc(c(c(c2)F)OCC(=O)N)F |
InChI | InChI | 1.03 | InChI=1S/C16H16F2N2O4S2/c17-13-8-11(9-14(18)16(13)24-10-15(19)21)25-7-6-20-26(22,23)12-4-2-1-3-5-12/h1-5,8-9,20H,6-7,10H2,(H2,19,21) |
InChIKey | InChI | 1.03 | GTACSIONMHMRPD-UHFFFAOYSA-N |