| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(Nc1cc2CNCc2cc1)c1cc2cnsc2cc1 |
| InChI | InChI | 1.06 | InChI=1S/C16H13N3OS/c20-16(10-2-4-15-13(5-10)9-18-21-15)19-14-3-1-11-7-17-8-12(11)6-14/h1-6,9,17H,7-8H2,(H,19,20) |
| InChIKey | InChI | 1.06 | DYBYRVCDONHDBA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C(Nc1ccc2CNCc2c1)c3ccc4sncc4c3 |
| SMILES | CACTVS | 3.385 | O=C(Nc1ccc2CNCc2c1)c3ccc4sncc4c3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1cc2c(cc1C(=O)Nc3ccc4c(c3)CNC4)cns2 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1cc2c(cc1C(=O)Nc3ccc4c(c3)CNC4)cns2 |
