YP6
Summary
| Name: | 2-(3-fluoranylphenoxy)-~{N}-(4-pyridin-2-yl-1,3-thiazol-2-yl)ethanamide |
| Formula: | C16 H12 F N3 O2 S |
| Formal charge: | 0 |
| Formula weight: | 329.349 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 2-(3-fluoranylphenoxy)-~{N}-(4-pyridin-2-yl-1,3-thiazol-2-yl)ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H12FN3O2S/c17-11-4-3-5-12(8-11)22-9-15(21)20-16-19-14(10-23-16)13-6-1-2-7-18-13/h1-8,10H,9H2,(H,19,20,21) |
| InChIKey | InChI | 1.03 | NMSQSTANKRXRFA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Fc1cccc(OCC(=O)Nc2scc(n2)c3ccccn3)c1 |
| SMILES | CACTVS | 3.385 | Fc1cccc(OCC(=O)Nc2scc(n2)c3ccccn3)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccnc(c1)c2csc(n2)NC(=O)COc3cccc(c3)F |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccnc(c1)c2csc(n2)NC(=O)COc3cccc(c3)F |
