| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CC1(CCC1)C(=O)NCC(Nc1ncnc2[NH]cnc21)C(C)C |
| InChI | InChI | 1.06 | InChI=1S/C16H24N6O/c1-10(2)11(7-17-15(23)16(3)5-4-6-16)22-14-12-13(19-8-18-12)20-9-21-14/h8-11H,4-7H2,1-3H3,(H,17,23)(H2,18,19,20,21,22)/t11-/m1/s1 |
| InChIKey | InChI | 1.06 | RZITUVZKCFWKQP-LLVKDONJSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)[C@@H](CNC(=O)C1(C)CCC1)Nc2ncnc3[nH]cnc23 |
| SMILES | CACTVS | 3.385 | CC(C)[CH](CNC(=O)C1(C)CCC1)Nc2ncnc3[nH]cnc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)[C@@H](CNC(=O)C1(CCC1)C)Nc2c3c([nH]cn3)ncn2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)C(CNC(=O)C1(CCC1)C)Nc2c3c([nH]cn3)ncn2 |
