F9C
Summary
| Name: | 1-(6-bromanyl-7-methyl-imidazo[4,5-b]pyridin-3-yl)-3-[(2R,3S)-3-oxidanylpiperidin-2-yl]propan-2-one |
| Formula: | C15 H19 Br N4 O2 |
| Formal charge: | 0 |
| Formula weight: | 367.241 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1-(6-bromanyl-7-methyl-imidazo[4,5-b]pyridin-3-yl)-3-[(2~{R},3~{S})-3-oxidanylpiperidin-2-yl]propan-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H19BrN4O2/c1-9-11(16)6-18-15-14(9)19-8-20(15)7-10(21)5-12-13(22)3-2-4-17-12/h6,8,12-13,17,22H,2-5,7H2,1H3/t12-,13+/m1/s1 |
| InChIKey | InChI | 1.03 | HASBACODFIEZPY-OLZOCXBDSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1c(Br)cnc2n(CC(=O)C[C@H]3NCCC[C@@H]3O)cnc12 |
| SMILES | CACTVS | 3.385 | Cc1c(Br)cnc2n(CC(=O)C[CH]3NCCC[CH]3O)cnc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1c(cnc2c1ncn2CC(=O)C[C@@H]3[C@H](CCCN3)O)Br |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1c(cnc2c1ncn2CC(=O)CC3C(CCCN3)O)Br |
