| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(Nc1nc(CP(=O)(OCC)OCC)cs1)c1cc(Oc2ccc(cc2)S(C)(=O)=O)cc(OC(C)COC)c1 |
| InChI | InChI | 1.03 | InChI=1S/C26H33N2O9PS2/c1-6-34-38(30,35-7-2)16-20-17-39-26(27-20)28-25(29)19-12-22(36-18(3)15-33-4)14-23(13-19)37-21-8-10-24(11-9-21)40(5,31)32/h8-14,17-18H,6-7,15-16H2,1-5H3,(H,27,28,29)/t18-/m0/s1 |
| InChIKey | InChI | 1.03 | OQUMCVQSAWPKMT-SFHVURJKSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCO[P](=O)(Cc1csc(NC(=O)c2cc(O[C@@H](C)COC)cc(Oc3ccc(cc3)[S](C)(=O)=O)c2)n1)OCC |
| SMILES | CACTVS | 3.385 | CCO[P](=O)(Cc1csc(NC(=O)c2cc(O[CH](C)COC)cc(Oc3ccc(cc3)[S](C)(=O)=O)c2)n1)OCC |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCOP(=O)(Cc1csc(n1)NC(=O)c2cc(cc(c2)O[C@@H](C)COC)Oc3ccc(cc3)S(=O)(=O)C)OCC |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCOP(=O)(Cc1csc(n1)NC(=O)c2cc(cc(c2)OC(C)COC)Oc3ccc(cc3)S(=O)(=O)C)OCC |
