O6Z
Summary
Name: | ~{N}-(1~{H}-indazol-5-yl)butane-1-sulfonamide |
Formula: | C11 H15 N3 O2 S |
Formal charge: | 0 |
Formula weight: | 253.321 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | ~{N}-(1~{H}-indazol-5-yl)butane-1-sulfonamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C11H15N3O2S/c1-2-3-6-17(15,16)14-10-4-5-11-9(7-10)8-12-13-11/h4-5,7-8,14H,2-3,6H2,1H3,(H,12,13) |
InChIKey | InChI | 1.03 | OPXDHLZGQKADDC-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCCC[S](=O)(=O)Nc1ccc2[nH]ncc2c1 |
SMILES | CACTVS | 3.385 | CCCC[S](=O)(=O)Nc1ccc2[nH]ncc2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCS(=O)(=O)Nc1ccc2c(c1)cn[nH]2 |
SMILES | OpenEye OEToolkits | 2.0.7 | CCCCS(=O)(=O)Nc1ccc2c(c1)cn[nH]2 |