| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=S(c2ccc1c(nc(n1)NC(=O)OC)c2)CCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCC[S@](=O)c1ccc2[nH]c(NC(=O)OC)nc2c1 |
| SMILES | CACTVS | 3.341 | CCC[S](=O)c1ccc2[nH]c(NC(=O)OC)nc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCS(=O)c1ccc2c(c1)nc([nH]2)NC(=O)OC |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCS(=O)c1ccc2c(c1)nc([nH]2)NC(=O)OC |
| InChI | InChI | 1.03 | InChI=1S/C12H15N3O3S/c1-3-6-19(17)8-4-5-9-10(7-8)14-11(13-9)15-12(16)18-2/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15,16)/t19-/m0/s1 |
| InChIKey | InChI | 1.03 | VXTGHWHFYNYFFV-IBGZPJMESA-N |
