M4I
Summary
| Name: | ~{N}-methyl-3-propan-2-yl-1~{H}-pyrazolo[3,4-c]pyridine-4-carboxamide |
| Formula: | C11 H14 N4 O |
| Formal charge: | 0 |
| Formula weight: | 218.255 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-methyl-3-propan-2-yl-1~{H}-pyrazolo[3,4-c]pyridine-4-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C11H14N4O/c1-6(2)10-9-7(11(16)12-3)4-13-5-8(9)14-15-10/h4-6H,1-3H3,(H,12,16)(H,14,15) |
| InChIKey | InChI | 1.06 | GEGYOOMXCGLHBJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNC(=O)c1cncc2[nH]nc(C(C)C)c12 |
| SMILES | CACTVS | 3.385 | CNC(=O)c1cncc2[nH]nc(C(C)C)c12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)c1c2c(cncc2[nH]n1)C(=O)NC |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)c1c2c(cncc2[nH]n1)C(=O)NC |
