Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Fc1c(cc(cc1)S(=O)(=O)NC(C(=O)NO)C)C |
InChI | InChI | 1.03 | InChI=1S/C10H13FN2O4S/c1-6-5-8(3-4-9(6)11)18(16,17)13-7(2)10(14)12-15/h3-5,7,13,15H,1-2H3,(H,12,14)/t7-/m1/s1 |
InChIKey | InChI | 1.03 | PGNDHTMCXOFNMS-SSDOTTSWSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H](N[S](=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |
SMILES | CACTVS | 3.385 | C[CH](N[S](=O)(=O)c1ccc(F)c(C)c1)C(=O)NO |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | Cc1cc(ccc1F)S(=O)(=O)N[C@H](C)C(=O)NO |
SMILES | OpenEye OEToolkits | 1.9.2 | Cc1cc(ccc1F)S(=O)(=O)NC(C)C(=O)NO |