| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=S(=O)(O)c1cccc(c1)COc3c2c(nc(nc2N)N)ccc3 |
| InChI | InChI | 1.03 | InChI=1S/C15H14N4O4S/c16-14-13-11(18-15(17)19-14)5-2-6-12(13)23-8-9-3-1-4-10(7-9)24(20,21)22/h1-7H,8H2,(H,20,21,22)(H4,16,17,18,19) |
| InChIKey | InChI | 1.03 | FEIMDUGCGJFTCE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1nc(N)c2c(OCc3cccc(c3)[S](O)(=O)=O)cccc2n1 |
| SMILES | CACTVS | 3.385 | Nc1nc(N)c2c(OCc3cccc(c3)[S](O)(=O)=O)cccc2n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(cc(c1)S(=O)(=O)O)COc2cccc3c2c(nc(n3)N)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(cc(c1)S(=O)(=O)O)COc2cccc3c2c(nc(n3)N)N |
