| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Cc1cc(Nc2ncc(C)c(n2)N2CC(O)(C2)C2CC2)sn1 |
| InChI | InChI | 1.06 | InChI=1S/C15H19N5OS/c1-9-6-16-14(17-12-5-10(2)19-22-12)18-13(9)20-7-15(21,8-20)11-3-4-11/h5-6,11,21H,3-4,7-8H2,1-2H3,(H,16,17,18) |
| InChIKey | InChI | 1.06 | AYYRUOOCJNTWHJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc(Nc2ncc(C)c(n2)N3CC(O)(C3)C4CC4)sn1 |
| SMILES | CACTVS | 3.385 | Cc1cc(Nc2ncc(C)c(n2)N3CC(O)(C3)C4CC4)sn1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(sn1)Nc2ncc(c(n2)N3CC(C3)(C4CC4)O)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(sn1)Nc2ncc(c(n2)N3CC(C3)(C4CC4)O)C |
