A2W
Summary
| Name: | 3-(4-fluorophenyl)-4-(imidazol-1-ylmethyl)-1-phenyl-pyrazole |
| Formula: | C19 H15 F N4 |
| Formal charge: | 0 |
| Formula weight: | 318.348 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 3-(4-fluorophenyl)-4-(imidazol-1-ylmethyl)-1-phenyl-pyrazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C19H15FN4/c20-17-8-6-15(7-9-17)19-16(12-23-11-10-21-14-23)13-24(22-19)18-4-2-1-3-5-18/h1-11,13-14H,12H2 |
| InChIKey | InChI | 1.03 | KWPMFVYWNXVKNC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Fc1ccc(cc1)c2nn(cc2Cn3ccnc3)c4ccccc4 |
| SMILES | CACTVS | 3.385 | Fc1ccc(cc1)c2nn(cc2Cn3ccnc3)c4ccccc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)n2cc(c(n2)c3ccc(cc3)F)Cn4ccnc4 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)n2cc(c(n2)c3ccc(cc3)F)Cn4ccnc4 |
