| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc2c(c1cccc3c1c(c2)COC3)c4nc(nc(SC)n4)N |
| InChI | InChI | 1.03 | InChI=1S/C16H13ClN4OS/c1-23-16-20-14(19-15(18)21-16)13-10-4-2-3-8-6-22-7-9(12(8)10)5-11(13)17/h2-5H,6-7H2,1H3,(H2,18,19,20,21) |
| InChIKey | InChI | 1.03 | FPTCGMGLTQPTGE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CSc1nc(N)nc(n1)c2c(Cl)cc3COCc4cccc2c34 |
| SMILES | CACTVS | 3.370 | CSc1nc(N)nc(n1)c2c(Cl)cc3COCc4cccc2c34 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | CSc1nc(nc(n1)N)c2c3cccc4c3c(cc2Cl)COC4 |
| SMILES | OpenEye OEToolkits | 1.7.2 | CSc1nc(nc(n1)N)c2c3cccc4c3c(cc2Cl)COC4 |
