| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(c1nc(sc1)n3ncc2ccccc23)Nc5ccccc5N4CCNCC4 |
| InChI | InChI | 1.03 | InChI=1S/C21H20N6OS/c28-20(24-16-6-2-4-8-19(16)26-11-9-22-10-12-26)17-14-29-21(25-17)27-18-7-3-1-5-15(18)13-23-27/h1-8,13-14,22H,9-12H2,(H,24,28) |
| InChIKey | InChI | 1.03 | WQIZBWOPEUALCL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | O=C(Nc1ccccc1N2CCNCC2)c3csc(n3)n4ncc5ccccc45 |
| SMILES | CACTVS | 3.370 | O=C(Nc1ccccc1N2CCNCC2)c3csc(n3)n4ncc5ccccc45 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc2c(c1)cnn2c3nc(cs3)C(=O)Nc4ccccc4N5CCNCC5 |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc2c(c1)cnn2c3nc(cs3)C(=O)Nc4ccccc4N5CCNCC5 |
