M4K
Summary
| Name: | 6-[[cyclopropyl-(phenylmethyl)amino]methyl]-5~{H}-pyrimidine-2,4-dione |
| Formula: | C15 H17 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 271.314 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 6-[[cyclopropyl-(phenylmethyl)amino]methyl]-5~{H}-pyrimidine-2,4-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H17N3O2/c19-14-8-12(16-15(20)17-14)10-18(13-6-7-13)9-11-4-2-1-3-5-11/h1-5,13H,6-10H2,(H,17,19,20) |
| InChIKey | InChI | 1.03 | DKPZCWNOVJTLGU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1CC(=NC(=O)N1)CN(Cc2ccccc2)C3CC3 |
| SMILES | CACTVS | 3.385 | O=C1CC(=NC(=O)N1)CN(Cc2ccccc2)C3CC3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)CN(CC2=NC(=O)NC(=O)C2)C3CC3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)CN(CC2=NC(=O)NC(=O)C2)C3CC3 |
