8E3
概要
| 表記: | 6-fluoranyl-2-(4,5,6,7-tetrahydrofuro[2,3-c]pyridin-2-yl)-1~{H}-benzimidazole-4-carboxamide |
| 組成式: | C15 H13 F N4 O2 |
| 電荷: | 0 |
| 化学式量: | 300.288 Da |
| 分子種別: | NON-POLYMER |
化合物名
| プログラム | バージョン | 表記 |
| OpenEye OEToolkits | 2.0.6 | 6-fluoranyl-2-(4,5,6,7-tetrahydrofuro[2,3-c]pyridin-2-yl)-1~{H}-benzimidazole-4-carboxamide |
化合物記述子（線形表記）
| 種別 | プログラム | バージョン | 表記 |
| InChI | InChI | 1.03 | InChI=1S/C15H13FN4O2/c16-8-4-9(14(17)21)13-10(5-8)19-15(20-13)11-3-7-1-2-18-6-12(7)22-11/h3-5,18H,1-2,6H2,(H2,17,21)(H,19,20) |
| InChIKey | InChI | 1.03 | BLVQSAHMDXWBNC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)c1cc(F)cc2[nH]c(nc12)c3oc4CNCCc4c3 |
| SMILES | CACTVS | 3.385 | NC(=O)c1cc(F)cc2[nH]c(nc12)c3oc4CNCCc4c3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1c(cc2c(c1C(=O)N)nc([nH]2)c3cc4c(o3)CNCC4)F |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1c(cc2c(c1C(=O)N)nc([nH]2)c3cc4c(o3)CNCC4)F |
