A1EJV
Summary
| Name: | 3-azanyl-7-chloranyl-4-(7-fluoranyl-1H-indazol-4-yl)-1H-1,5-naphthyridin-2-one |
| Formula: | C15 H9 Cl F N5 O |
| Formal charge: | 0 |
| Formula weight: | 329.716 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3-azanyl-7-chloranyl-4-(7-fluoranyl-1~{H}-indazol-4-yl)-1~{H}-1,5-naphthyridin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C15H9ClFN5O/c16-6-3-10-14(19-4-6)11(12(18)15(23)21-10)7-1-2-9(17)13-8(7)5-20-22-13/h1-5H,18H2,(H,20,22)(H,21,23) |
| InChIKey | InChI | 1.06 | MKTDTVNSMKCRFX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC1=C(c2ccc(F)c3[nH]ncc23)c4ncc(Cl)cc4NC1=O |
| SMILES | CACTVS | 3.385 | NC1=C(c2ccc(F)c3[nH]ncc23)c4ncc(Cl)cc4NC1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c2c(c1C3=C(C(=O)Nc4c3ncc(c4)Cl)N)cn[nH]2)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c2c(c1C3=C(C(=O)Nc4c3ncc(c4)Cl)N)cn[nH]2)F |
