ZUF
Summary
| Name: | ~{N}-(5-chloranylpyridin-2-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine |
| Formula: | C13 H9 Cl N4 S |
| Formal charge: | 0 |
| Formula weight: | 288.755 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | ~{N}-(5-chloranylpyridin-2-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H9ClN4S/c14-9-4-5-12(16-7-9)18-13-17-11(8-19-13)10-3-1-2-6-15-10/h1-8H,(H,16,17,18) |
| InChIKey | InChI | 1.03 | XIMLXPRKZACEAD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccc(Nc2scc(n2)c3ccccn3)nc1 |
| SMILES | CACTVS | 3.385 | Clc1ccc(Nc2scc(n2)c3ccccn3)nc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccnc(c1)c2csc(n2)Nc3ccc(cn3)Cl |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccnc(c1)c2csc(n2)Nc3ccc(cn3)Cl |
