OGE
Summary
| Name: | 1-(5-bromanylpyridin-2-yl)-3-(2-hydroxyethyl)urea |
| Formula: | C8 H10 Br N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 260.088 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1-(5-bromanylpyridin-2-yl)-3-(2-hydroxyethyl)urea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C8H10BrN3O2/c9-6-1-2-7(11-5-6)12-8(14)10-3-4-13/h1-2,5,13H,3-4H2,(H2,10,11,12,14) |
| InChIKey | InChI | 1.03 | DWHYNYBZZGQFNY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OCCNC(=O)Nc1ccc(Br)cn1 |
| SMILES | CACTVS | 3.385 | OCCNC(=O)Nc1ccc(Br)cn1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(ncc1Br)NC(=O)NCCO |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ncc1Br)NC(=O)NCCO |
