F92
Summary
| Name: | 4-[5-(2-azanylpyrimidin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]cyclohexan-1-ol |
| Formula: | C19 H20 F N5 O |
| Formal charge: | 0 |
| Formula weight: | 353.393 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 4-[5-(2-azanylpyrimidin-4-yl)-4-(4-fluorophenyl)imidazol-1-yl]cyclohexan-1-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C19H20FN5O/c20-13-3-1-12(2-4-13)17-18(16-9-10-22-19(21)24-16)25(11-23-17)14-5-7-15(26)8-6-14/h1-4,9-11,14-15,26H,5-8H2,(H2,21,22,24)/t14-,15- |
| InChIKey | InChI | 1.03 | YNEJNUAUXPCFAS-SHTZXODSSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1nccc(n1)c2n(cnc2c3ccc(F)cc3)[C@H]4CC[C@H](O)CC4 |
| SMILES | CACTVS | 3.385 | Nc1nccc(n1)c2n(cnc2c3ccc(F)cc3)[CH]4CC[CH](O)CC4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1c2c(n(cn2)C3CCC(CC3)O)c4ccnc(n4)N)F |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1c2c(n(cn2)C3CCC(CC3)O)c4ccnc(n4)N)F |
