FFN
Summary
| Name: | 5-(4-fluorophenyl)-2-methyl-3~{H}-thieno[2,3-d]pyrimidin-4-one |
| Formula: | C13 H9 F N2 O S |
| Formal charge: | 0 |
| Formula weight: | 260.287 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 5-(4-fluorophenyl)-2-methyl-3~{H}-thieno[2,3-d]pyrimidin-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H9FN2OS/c1-7-15-12(17)11-10(6-18-13(11)16-7)8-2-4-9(14)5-3-8/h2-6H,1H3,(H,15,16,17) |
| InChIKey | InChI | 1.03 | PEYKEBUFADUZJK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC1=Nc2scc(c3ccc(F)cc3)c2C(=O)N1 |
| SMILES | CACTVS | 3.385 | CC1=Nc2scc(c3ccc(F)cc3)c2C(=O)N1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC1=Nc2c(c(cs2)c3ccc(cc3)F)C(=O)N1 |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC1=Nc2c(c(cs2)c3ccc(cc3)F)C(=O)N1 |
