| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | NC(=O)C1CCC(=O)N(C1)Cc1ccc2cnn(C)c2c1 |
| InChI | InChI | 1.06 | InChI=1S/C15H18N4O2/c1-18-13-6-10(2-3-11(13)7-17-18)8-19-9-12(15(16)21)4-5-14(19)20/h2-3,6-7,12H,4-5,8-9H2,1H3,(H2,16,21)/t12-/m0/s1 |
| InChIKey | InChI | 1.06 | ICAOAIIRHBCCAZ-LBPRGKRZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1ncc2ccc(CN3C[C@H](CCC3=O)C(N)=O)cc12 |
| SMILES | CACTVS | 3.385 | Cn1ncc2ccc(CN3C[CH](CCC3=O)C(N)=O)cc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | Cn1c2cc(ccc2cn1)CN3C[C@H](CCC3=O)C(=O)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | Cn1c2cc(ccc2cn1)CN3CC(CCC3=O)C(=O)N |
