N8U
Summary
Name: | ~{N}-(1~{H}-indazol-5-yl)ethanesulfonamide |
Formula: | C9 H11 N3 O2 S |
Formal charge: | 0 |
Formula weight: | 225.268 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | ~{N}-(1~{H}-indazol-5-yl)ethanesulfonamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C9H11N3O2S/c1-2-15(13,14)12-8-3-4-9-7(5-8)6-10-11-9/h3-6,12H,2H2,1H3,(H,10,11) |
InChIKey | InChI | 1.06 | RCLHSLDLIZMGRM-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC[S](=O)(=O)Nc1ccc2[nH]ncc2c1 |
SMILES | CACTVS | 3.385 | CC[S](=O)(=O)Nc1ccc2[nH]ncc2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCS(=O)(=O)Nc1ccc2c(c1)cn[nH]2 |
SMILES | OpenEye OEToolkits | 2.0.7 | CCS(=O)(=O)Nc1ccc2c(c1)cn[nH]2 |