| 種別 | プログラム | バージョン | 表記 |
| InChI | InChI | 1.06 | InChI=1S/C20H15Cl2N5O3/c21-13-5-4-10(8-14(13)22)6-7-27-19-16(25-20(27)30)15(17(23)29)24-18(26-19)11-2-1-3-12(28)9-11/h1-5,8-9,28H,6-7H2,(H2,23,29)(H,25,30) |
| InChIKey | InChI | 1.06 | ZOEBAQBSIASRNL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)c1nc(nc2N(CCc3ccc(Cl)c(Cl)c3)C(=O)Nc12)c4cccc(O)c4 |
| SMILES | CACTVS | 3.385 | NC(=O)c1nc(nc2N(CCc3ccc(Cl)c(Cl)c3)C(=O)Nc12)c4cccc(O)c4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1cc(cc(c1)O)c2nc(c3c(n2)N(C(=O)N3)CCc4ccc(c(c4)Cl)Cl)C(=O)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1cc(cc(c1)O)c2nc(c3c(n2)N(C(=O)N3)CCc4ccc(c(c4)Cl)Cl)C(=O)N |
