| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 10.04 | Fc1ccc2c3c1c(cc(c3C(=O)N2)c4cccn4)NCCN |
| SMILES_CANONICAL | CACTVS | 3.341 | NCCNc1cc(c2[nH]ccc2)c3C(=O)Nc4ccc(F)c1c34 |
| SMILES | CACTVS | 3.341 | NCCNc1cc(c2[nH]ccc2)c3C(=O)Nc4ccc(F)c1c34 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc([nH]c1)c2cc(c3c(ccc4c3c2C(=O)N4)F)NCCN |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc([nH]c1)c2cc(c3c(ccc4c3c2C(=O)N4)F)NCCN |
| InChI | InChI | 1.03 | InChI=1S/C17H15FN4O/c18-10-3-4-12-16-14(17(23)22-12)9(11-2-1-6-20-11)8-13(15(10)16)21-7-5-19/h1-4,6,8,20-21H,5,7,19H2,(H,22,23) |
| InChIKey | InChI | 1.03 | CQCXWWWNUFQYJS-UHFFFAOYSA-N |
