| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc4ccccc4C2=NCc1nnc([n+]1c3sc(cc23)CC)C |
| InChI | InChI | 1.03 | InChI=1S/C17H15ClN4S/c1-3-11-8-13-16(12-6-4-5-7-14(12)18)19-9-15-21-20-10(2)22(15)17(13)23-11/h4-8H,3,9H2,1-2H3/p+1 |
| InChIKey | InChI | 1.03 | VMZUTJCNQWMAGF-UHFFFAOYSA-O |
| SMILES_CANONICAL | CACTVS | 3.385 | CCc1sc2c(c1)C(=NCc3n[nH]c(C)[n+]23)c4ccccc4Cl |
| SMILES | CACTVS | 3.385 | CCc1sc2c(c1)C(=NCc3n[nH]c(C)[n+]23)c4ccccc4Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCc1cc2c(s1)-[n+]3c([nH]nc3CN=C2c4ccccc4Cl)C |
| SMILES | OpenEye OEToolkits | 1.7.6 | CCc1cc2c(s1)-[n+]3c([nH]nc3CN=C2c4ccccc4Cl)C |
