| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(c3c(N)n(nc3c1nc2c(cc1)cccc2)C(C)(C)C)N |
| InChI | InChI | 1.03 | InChI=1S/C17H19N5O/c1-17(2,3)22-15(18)13(16(19)23)14(21-22)12-9-8-10-6-4-5-7-11(10)20-12/h4-9H,18H2,1-3H3,(H2,19,23) |
| InChIKey | InChI | 1.03 | YKVANMRHVMVLJX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)(C)n1nc(c2ccc3ccccc3n2)c(C(N)=O)c1N |
| SMILES | CACTVS | 3.385 | CC(C)(C)n1nc(c2ccc3ccccc3n2)c(C(N)=O)c1N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(C)(C)n1c(c(c(n1)c2ccc3ccccc3n2)C(=O)N)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC(C)(C)n1c(c(c(n1)c2ccc3ccccc3n2)C(=O)N)N |
