245
Summary
| Name: | 1-(2-chloropyridin-4-yl)-3-phenylurea |
| Formula: | C12 H10 Cl N3 O |
| Formal charge: | 0 |
| Formula weight: | 247.68 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 1-(2-chloropyridin-4-yl)-3-phenylurea |
| OpenEye OEToolkits | 1.5.0 | 3-(2-chloropyridin-4-yl)-1-phenyl-urea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Clc2nccc(NC(=O)Nc1ccccc1)c2 |
| SMILES_CANONICAL | CACTVS | 3.341 | Clc1cc(NC(=O)Nc2ccccc2)ccn1 |
| SMILES | CACTVS | 3.341 | Clc1cc(NC(=O)Nc2ccccc2)ccn1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)NC(=O)Nc2ccnc(c2)Cl |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)NC(=O)Nc2ccnc(c2)Cl |
| InChI | InChI | 1.03 | InChI=1S/C12H10ClN3O/c13-11-8-10(6-7-14-11)16-12(17)15-9-4-2-1-3-5-9/h1-8H,(H2,14,15,16,17) |
| InChIKey | InChI | 1.03 | GPXLRLUVLMHHIK-UHFFFAOYSA-N |
