| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | COc3cccc(CC(Nc1nc(cs1)c2ccnc(c2)N)=O)c3 |
| InChI | InChI | 1.03 | InChI=1S/C17H16N4O2S/c1-23-13-4-2-3-11(7-13)8-16(22)21-17-20-14(10-24-17)12-5-6-19-15(18)9-12/h2-7,9-10H,8H2,1H3,(H2,18,19)(H,20,21,22) |
| InChIKey | InChI | 1.03 | HIGGJLMBFDDVKA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cccc(CC(=O)Nc2scc(n2)c3ccnc(N)c3)c1 |
| SMILES | CACTVS | 3.385 | COc1cccc(CC(=O)Nc2scc(n2)c3ccnc(N)c3)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COc1cccc(c1)CC(=O)Nc2nc(cs2)c3ccnc(c3)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | COc1cccc(c1)CC(=O)Nc2nc(cs2)c3ccnc(c3)N |
