YNF
Summary
| Name: | ~{N}-butyl-4-chloranyl-2-cyclohexylsulfanyl-5-sulfamoyl-benzamide |
| Formula: | C17 H25 Cl N2 O3 S2 |
| Formal charge: | 0 |
| Formula weight: | 404.975 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-butyl-4-chloranyl-2-cyclohexylsulfanyl-5-sulfamoyl-benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C17H25ClN2O3S2/c1-2-3-9-20-17(21)13-10-16(25(19,22)23)14(18)11-15(13)24-12-7-5-4-6-8-12/h10-12H,2-9H2,1H3,(H,20,21)(H2,19,22,23) |
| InChIKey | InChI | 1.06 | WZHPNNQXMINMAU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCNC(=O)c1cc(c(Cl)cc1SC2CCCCC2)[S](N)(=O)=O |
| SMILES | CACTVS | 3.385 | CCCCNC(=O)c1cc(c(Cl)cc1SC2CCCCC2)[S](N)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCNC(=O)c1cc(c(cc1SC2CCCCC2)Cl)S(=O)(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCNC(=O)c1cc(c(cc1SC2CCCCC2)Cl)S(=O)(=O)N |
