| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=S(=O)(c1ccc(cc1)C)NC5CC(C(=O)NCC3c4c(Oc2c3cccc2)cccc4)CNC5 |
| InChI | InChI | 1.03 | InChI=1S/C27H29N3O4S/c1-18-10-12-21(13-11-18)35(32,33)30-20-14-19(15-28-16-20)27(31)29-17-24-22-6-2-4-8-25(22)34-26-9-5-3-7-23(24)26/h2-13,19-20,24,28,30H,14-17H2,1H3,(H,29,31)/t19-,20+/m0/s1 |
| InChIKey | InChI | 1.03 | SOEKUZSTSXYGKH-VQTJNVASSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | Cc1ccc(cc1)[S](=O)(=O)N[C@H]2CNC[C@H](C2)C(=O)NC[C@H]3c4ccccc4Oc5ccccc35 |
| SMILES | CACTVS | 3.370 | Cc1ccc(cc1)[S](=O)(=O)N[CH]2CNC[CH](C2)C(=O)NC[CH]3c4ccccc4Oc5ccccc35 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | Cc1ccc(cc1)S(=O)(=O)N[C@@H]2C[C@@H](CNC2)C(=O)NCC3c4ccccc4Oc5c3cccc5 |
| SMILES | OpenEye OEToolkits | 1.7.6 | Cc1ccc(cc1)S(=O)(=O)NC2CC(CNC2)C(=O)NCC3c4ccccc4Oc5c3cccc5 |
