6Q0
Summary
| Name: | ~{N}-[[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]methyl]benzenesulfonamide |
| Formula: | C18 H18 N2 O3 S |
| Formal charge: | 0 |
| Formula weight: | 342.412 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | ~{N}-[[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]methyl]benzenesulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C18H18N2O3S/c1-13-18(14(2)23-20-13)16-10-8-15(9-11-16)12-19-24(21,22)17-6-4-3-5-7-17/h3-11,19H,12H2,1-2H3 |
| InChIKey | InChI | 1.03 | RZFYAEOEPOUGRI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1onc(C)c1c2ccc(CN[S](=O)(=O)c3ccccc3)cc2 |
| SMILES | CACTVS | 3.385 | Cc1onc(C)c1c2ccc(CN[S](=O)(=O)c3ccccc3)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | Cc1c(c(on1)C)c2ccc(cc2)CNS(=O)(=O)c3ccccc3 |
| SMILES | OpenEye OEToolkits | 2.0.5 | Cc1c(c(on1)C)c2ccc(cc2)CNS(=O)(=O)c3ccccc3 |
