| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=S(=O)(N(C3C(N(Cc1ccc(I)cc1)S(=O)(=O)c2ccccc2)CNC3)Cc4ccc(I)cc4)c5ccccc5 |
| SMILES_CANONICAL | CACTVS | 3.341 | Ic1ccc(CN([C@H]2CNC[C@@H]2N(Cc3ccc(I)cc3)[S](=O)(=O)c4ccccc4)[S](=O)(=O)c5ccccc5)cc1 |
| SMILES | CACTVS | 3.341 | Ic1ccc(CN([CH]2CNC[CH]2N(Cc3ccc(I)cc3)[S](=O)(=O)c4ccccc4)[S](=O)(=O)c5ccccc5)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)S(=O)(=O)N(Cc2ccc(cc2)I)[C@H]3CNC[C@@H]3N(Cc4ccc(cc4)I)S(=O)(=O)c5ccccc5 |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)S(=O)(=O)N(Cc2ccc(cc2)I)C3CNCC3N(Cc4ccc(cc4)I)S(=O)(=O)c5ccccc5 |
| InChI | InChI | 1.03 | InChI=1S/C30H29I2N3O4S2/c31-25-15-11-23(12-16-25)21-34(40(36,37)27-7-3-1-4-8-27)29-19-33-20-30(29)35(22-24-13-17-26(32)18-14-24)41(38,39)28-9-5-2-6-10-28/h1-18,29-30,33H,19-22H2/t29-,30-/m0/s1 |
| InChIKey | InChI | 1.03 | ALNICVDMFYPVLU-KYJUHHDHSA-N |
