| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C2C(=Cc1c(nc(nc1C)NC)N2C3CCCC3)c4cccc(c4)CO |
| SMILES_CANONICAL | CACTVS | 3.370 | CNc1nc(C)c2C=C(C(=O)N(C3CCCC3)c2n1)c4cccc(CO)c4 |
| SMILES | CACTVS | 3.370 | CNc1nc(C)c2C=C(C(=O)N(C3CCCC3)c2n1)c4cccc(CO)c4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | Cc1c2c(nc(n1)NC)N(C(=O)C(=C2)c3cccc(c3)CO)C4CCCC4 |
| SMILES | OpenEye OEToolkits | 1.7.0 | Cc1c2c(nc(n1)NC)N(C(=O)C(=C2)c3cccc(c3)CO)C4CCCC4 |
| InChI | InChI | 1.03 | InChI=1S/C21H24N4O2/c1-13-17-11-18(15-7-5-6-14(10-15)12-26)20(27)25(16-8-3-4-9-16)19(17)24-21(22-2)23-13/h5-7,10-11,16,26H,3-4,8-9,12H2,1-2H3,(H,22,23,24) |
| InChIKey | InChI | 1.03 | LASGWNJRSNLLFV-UHFFFAOYSA-N |
