| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n1cc(c(c2c1nc(nc2N)N)C)Cc3cc(OC)ccc3OC |
| SMILES_CANONICAL | CACTVS | 3.341 | COc1ccc(OC)c(Cc2cnc3nc(N)nc(N)c3c2C)c1 |
| SMILES | CACTVS | 3.341 | COc1ccc(OC)c(Cc2cnc3nc(N)nc(N)c3c2C)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1c(cnc2c1c(nc(n2)N)N)Cc3cc(ccc3OC)OC |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1c(cnc2c1c(nc(n2)N)N)Cc3cc(ccc3OC)OC |
| InChI | InChI | 1.03 | InChI=1S/C17H19N5O2/c1-9-11(6-10-7-12(23-2)4-5-13(10)24-3)8-20-16-14(9)15(18)21-17(19)22-16/h4-5,7-8H,6H2,1-3H3,(H4,18,19,20,21,22) |
| InChIKey | InChI | 1.03 | VJXSSYDSOJBUAV-UHFFFAOYSA-N |
