| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C21H27N5O5S/c1-10(2)7-25-20-17(18(28)24(5)21(25)30)16(19(29)26-8-13(27)9-31-26)15(32-20)6-14-11(3)22-23-12(14)4/h10,13,27H,6-9H2,1-5H3,(H,22,23)/t13-/m0/s1 |
| InChIKey | InChI | 1.06 | ISIVOJWVBJIOFM-ZDUSSCGKSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)CN1C(=O)N(C)C(=O)c2c1sc(Cc3c(C)[nH]nc3C)c2C(=O)N4C[C@H](O)CO4 |
| SMILES | CACTVS | 3.385 | CC(C)CN1C(=O)N(C)C(=O)c2c1sc(Cc3c(C)[nH]nc3C)c2C(=O)N4C[CH](O)CO4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1c(c(n[nH]1)C)Cc2c(c3c(s2)N(C(=O)N(C3=O)C)CC(C)C)C(=O)N4C[C@@H](CO4)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1c(c(n[nH]1)C)Cc2c(c3c(s2)N(C(=O)N(C3=O)C)CC(C)C)C(=O)N4CC(CO4)O |
