| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1(C(C)C)nnc(c1)C(N2CCC(C2)NC(C3CC3)=O)=O |
| InChI | InChI | 1.03 | InChI=1S/C15H22N4O2/c1-9(2)12-7-13(18-17-12)15(21)19-6-5-11(8-19)16-14(20)10-3-4-10/h7,9-11H,3-6,8H2,1-2H3,(H,16,20)(H,17,18)/t11-/m1/s1 |
| InChIKey | InChI | 1.03 | CXEXTVGTDZRKJS-LLVKDONJSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)c1cc([nH]n1)C(=O)N2CC[C@H](C2)NC(=O)C3CC3 |
| SMILES | CACTVS | 3.385 | CC(C)c1cc([nH]n1)C(=O)N2CC[CH](C2)NC(=O)C3CC3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(C)c1cc([nH]n1)C(=O)N2CC[C@H](C2)NC(=O)C3CC3 |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC(C)c1cc([nH]n1)C(=O)N2CCC(C2)NC(=O)C3CC3 |
