T6H
Summary
| Name: | 2-methyl-2-phenoxy-~{N}-(2-sulfanylethyl)propanamide |
| Formula: | C12 H17 N O2 S |
| Formal charge: | 0 |
| Formula weight: | 239.334 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-methyl-2-phenoxy-~{N}-(2-sulfanylethyl)propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H17NO2S/c1-12(2,11(14)13-8-9-16)15-10-6-4-3-5-7-10/h3-7,16H,8-9H2,1-2H3,(H,13,14) |
| InChIKey | InChI | 1.03 | BKIILAFCTOGNPQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)(Oc1ccccc1)C(=O)NCCS |
| SMILES | CACTVS | 3.385 | CC(C)(Oc1ccccc1)C(=O)NCCS |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)(C(=O)NCCS)Oc1ccccc1 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)(C(=O)NCCS)Oc1ccccc1 |
