A1BG2
Summary
| Name: | N-(3-methylpyridin-4-yl)-3-(1,3-thiazol-2-yl)benzamide |
| Formula: | C16 H13 N3 O S |
| Formal charge: | 0 |
| Formula weight: | 295.359 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | N-(3-methylpyridin-4-yl)-3-(1,3-thiazol-2-yl)benzamide |
| OpenEye OEToolkits | 3.1.0.0 | ~{N}-(3-methylpyridin-4-yl)-3-(1,3-thiazol-2-yl)benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | Cc1cnccc1NC(=O)c1cccc(c1)c1nccs1 |
| InChI | InChI | 1.06 | InChI=1S/C16H13N3OS/c1-11-10-17-6-5-14(11)19-15(20)12-3-2-4-13(9-12)16-18-7-8-21-16/h2-10H,1H3,(H,17,19,20) |
| InChIKey | InChI | 1.06 | HFFACLLXIVKSBM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cnccc1NC(=O)c2cccc(c2)c3sccn3 |
| SMILES | CACTVS | 3.385 | Cc1cnccc1NC(=O)c2cccc(c2)c3sccn3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | Cc1cnccc1NC(=O)c2cccc(c2)c3nccs3 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | Cc1cnccc1NC(=O)c2cccc(c2)c3nccs3 |
