N3X
Summary
| Name: | ~{N}-[(1-methylindazol-6-yl)methyl]propanamide |
| Formula: | C12 H15 N3 O |
| Formal charge: | 0 |
| Formula weight: | 217.267 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-[(1-methylindazol-6-yl)methyl]propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C12H15N3O/c1-3-12(16)13-7-9-4-5-10-8-14-15(2)11(10)6-9/h4-6,8H,3,7H2,1-2H3,(H,13,16) |
| InChIKey | InChI | 1.06 | BEDCFWJZXJLEPB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCC(=O)NCc1ccc2cnn(C)c2c1 |
| SMILES | CACTVS | 3.385 | CCC(=O)NCc1ccc2cnn(C)c2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCC(=O)NCc1ccc2cnn(c2c1)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCC(=O)NCc1ccc2cnn(c2c1)C |
