NWV
Summary
| Name: | N-[(1-methyl-1H-pyrazol-4-yl)methyl]furan-2-carboxamide |
| Formula: | C10 H11 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 205.213 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-[(1-methyl-1H-pyrazol-4-yl)methyl]furan-2-carboxamide |
| OpenEye OEToolkits | 2.0.6 | ~{N}-[(1-methylpyrazol-4-yl)methyl]furan-2-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N(Cc1cn(C)nc1)C(=O)c2ccco2 |
| InChI | InChI | 1.03 | InChI=1S/C10H11N3O2/c1-13-7-8(6-12-13)5-11-10(14)9-3-2-4-15-9/h2-4,6-7H,5H2,1H3,(H,11,14) |
| InChIKey | InChI | 1.03 | ZPCCCCZFCHPBOS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1cc(CNC(=O)c2occc2)cn1 |
| SMILES | CACTVS | 3.385 | Cn1cc(CNC(=O)c2occc2)cn1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cn1cc(cn1)CNC(=O)c2ccco2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cn1cc(cn1)CNC(=O)c2ccco2 |
