JHJ
Summary
| Name: | N-(4-methoxyphenyl)-N'-pyridin-4-ylurea |
| Formula: | C13 H13 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 243.261 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-(4-methoxyphenyl)-N'-pyridin-4-ylurea |
| OpenEye OEToolkits | 2.0.6 | 1-(4-methoxyphenyl)-3-pyridin-4-yl-urea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C(=O)(Nc1ccncc1)Nc2ccc(cc2)OC |
| InChI | InChI | 1.03 | InChI=1S/C13H13N3O2/c1-18-12-4-2-10(3-5-12)15-13(17)16-11-6-8-14-9-7-11/h2-9H,1H3,(H2,14,15,16,17) |
| InChIKey | InChI | 1.03 | IFKGCTGEAFOLOL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(NC(=O)Nc2ccncc2)cc1 |
| SMILES | CACTVS | 3.385 | COc1ccc(NC(=O)Nc2ccncc2)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COc1ccc(cc1)NC(=O)Nc2ccncc2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | COc1ccc(cc1)NC(=O)Nc2ccncc2 |
