M4E
Summary
Name: | ~{N}-methyl-2~{H}-indazole-3-carboxamide |
Formula: | C9 H9 N3 O |
Formal charge: | 0 |
Formula weight: | 175.187 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | ~{N}-methyl-1~{H}-indazole-3-carboxamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C9H9N3O/c1-10-9(13)8-6-4-2-3-5-7(6)11-12-8/h2-5H,1H3,(H,10,13)(H,11,12) |
InChIKey | InChI | 1.03 | WZVBKCJHULLMHK-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CNC(=O)c1n[nH]c2ccccc12 |
SMILES | CACTVS | 3.385 | CNC(=O)c1n[nH]c2ccccc12 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CNC(=O)c1c2ccccc2[nH]n1 |
SMILES | OpenEye OEToolkits | 2.0.7 | CNC(=O)c1c2ccccc2[nH]n1 |