6DP
Summary
Name: | ~{N}-(1~{H}-indazol-4-yl)methanesulfonamide |
Formula: | C8 H9 N3 O2 S |
Formal charge: | 0 |
Formula weight: | 211.241 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.5 | ~{N}-(1~{H}-indazol-4-yl)methanesulfonamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C8H9N3O2S/c1-14(12,13)11-8-4-2-3-7-6(8)5-9-10-7/h2-5,11H,1H3,(H,9,10) |
InChIKey | InChI | 1.03 | CAMWAWBWBXRPRP-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | C[S](=O)(=O)Nc1cccc2[nH]ncc12 |
SMILES | CACTVS | 3.385 | C[S](=O)(=O)Nc1cccc2[nH]ncc12 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | CS(=O)(=O)Nc1cccc2c1cn[nH]2 |
SMILES | OpenEye OEToolkits | 2.0.5 | CS(=O)(=O)Nc1cccc2c1cn[nH]2 |