| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(N)CCc1cc(ccc1)n4nc(c2c4cc(nc2)NC(c3ccccc3)C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | C[C@H](Nc1cc2n(nc(C)c2cn1)c3cccc(CCC(N)=O)c3)c4ccccc4 |
| SMILES | CACTVS | 3.341 | C[CH](Nc1cc2n(nc(C)c2cn1)c3cccc(CCC(N)=O)c3)c4ccccc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1c2cnc(cc2n(n1)c3cccc(c3)CCC(=O)N)N[C@@H](C)c4ccccc4 |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1c2cnc(cc2n(n1)c3cccc(c3)CCC(=O)N)NC(C)c4ccccc4 |
| InChI | InChI | 1.03 | InChI=1S/C24H25N5O/c1-16(19-8-4-3-5-9-19)27-24-14-22-21(15-26-24)17(2)28-29(22)20-10-6-7-18(13-20)11-12-23(25)30/h3-10,13-16H,11-12H2,1-2H3,(H2,25,30)(H,26,27)/t16-/m0/s1 |
| InChIKey | InChI | 1.03 | ZFGCLYUGFRNYFE-INIZCTEOSA-N |
