| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(Nc1nc(cs1)c1cn(C)nc1)Cc1ccccn1 |
| InChI | InChI | 1.06 | InChI=1S/C14H13N5OS/c1-19-8-10(7-16-19)12-9-21-14(17-12)18-13(20)6-11-4-2-3-5-15-11/h2-5,7-9H,6H2,1H3,(H,17,18,20) |
| InChIKey | InChI | 1.06 | WSCNLEAKCHOALM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1cc(cn1)c2csc(NC(=O)Cc3ccccn3)n2 |
| SMILES | CACTVS | 3.385 | Cn1cc(cn1)c2csc(NC(=O)Cc3ccccn3)n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | Cn1cc(cn1)c2csc(n2)NC(=O)Cc3ccccn3 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | Cn1cc(cn1)c2csc(n2)NC(=O)Cc3ccccn3 |
