| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n1c(c2nc(n(c2nc1)CCCC)Cc3cc(OC)ccc3OC)N |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCn1c(Cc2cc(OC)ccc2OC)nc3c(N)ncnc13 |
| SMILES | CACTVS | 3.341 | CCCCn1c(Cc2cc(OC)ccc2OC)nc3c(N)ncnc13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCn1c(nc2c1ncnc2N)Cc3cc(ccc3OC)OC |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCn1c(nc2c1ncnc2N)Cc3cc(ccc3OC)OC |
| InChI | InChI | 1.03 | InChI=1S/C18H23N5O2/c1-4-5-8-23-15(22-16-17(19)20-11-21-18(16)23)10-12-9-13(24-2)6-7-14(12)25-3/h6-7,9,11H,4-5,8,10H2,1-3H3,(H2,19,20,21) |
| InChIKey | InChI | 1.03 | PPFZLLAIQRZNJE-UHFFFAOYSA-N |
