6UJ
Summary
| Name: | 1-(2-methyl-4-phenyl-pyrimidin-5-yl)-3-naphthalen-1-yl-urea |
| Formula: | C22 H18 N4 O |
| Formal charge: | 0 |
| Formula weight: | 354.405 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | 1-(2-methyl-4-phenyl-pyrimidin-5-yl)-3-naphthalen-1-yl-urea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C22H18N4O/c1-15-23-14-20(21(24-15)17-9-3-2-4-10-17)26-22(27)25-19-13-7-11-16-8-5-6-12-18(16)19/h2-14H,1H3,(H2,25,26,27) |
| InChIKey | InChI | 1.03 | QTGKTWMSCVUXHK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ncc(NC(=O)Nc2cccc3ccccc23)c(n1)c4ccccc4 |
| SMILES | CACTVS | 3.385 | Cc1ncc(NC(=O)Nc2cccc3ccccc23)c(n1)c4ccccc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | Cc1ncc(c(n1)c2ccccc2)NC(=O)Nc3cccc4c3cccc4 |
| SMILES | OpenEye OEToolkits | 2.0.5 | Cc1ncc(c(n1)c2ccccc2)NC(=O)Nc3cccc4c3cccc4 |
