| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(OCc1ccccc1)NC4N=C(c2ccccc2n3c4nnc3C)c5ccccc5 |
| SMILES_CANONICAL | CACTVS | 3.370 | Cc1nnc2[C@H](NC(=O)OCc3ccccc3)N=C(c4ccccc4)c5ccccc5n12 |
| SMILES | CACTVS | 3.370 | Cc1nnc2[CH](NC(=O)OCc3ccccc3)N=C(c4ccccc4)c5ccccc5n12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | Cc1nnc2n1-c3ccccc3C(=N[C@H]2NC(=O)OCc4ccccc4)c5ccccc5 |
| SMILES | OpenEye OEToolkits | 1.7.0 | Cc1nnc2n1-c3ccccc3C(=NC2NC(=O)OCc4ccccc4)c5ccccc5 |
| InChI | InChI | 1.03 | InChI=1S/C25H21N5O2/c1-17-28-29-24-23(27-25(31)32-16-18-10-4-2-5-11-18)26-22(19-12-6-3-7-13-19)20-14-8-9-15-21(20)30(17)24/h2-15,23H,16H2,1H3,(H,27,31)/t23-/m0/s1 |
| InChIKey | InChI | 1.03 | TUWDLUFFAHHNEF-QHCPKHFHSA-N |
