A1CNE
Summary
| Name: | N-([1,1'-biphenyl]-4-yl)urea |
| Formula: | C13 H12 N2 O |
| Formal charge: | 0 |
| Formula weight: | 212.247 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | N-([1,1'-biphenyl]-4-yl)urea |
| OpenEye OEToolkits | 3.1.0.0 | 1-(4-phenylphenyl)urea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(N)Nc1ccc(cc1)c1ccccc1 |
| InChI | InChI | 1.06 | InChI=1S/C13H12N2O/c14-13(16)15-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H,(H3,14,15,16) |
| InChIKey | InChI | 1.06 | FAVOSJNIJZMFAB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)Nc1ccc(cc1)c2ccccc2 |
| SMILES | CACTVS | 3.385 | NC(=O)Nc1ccc(cc1)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1ccc(cc1)c2ccc(cc2)NC(=O)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1ccc(cc1)c2ccc(cc2)NC(=O)N |
