OQ9
Summary
| Name: | 4-methanoyl-~{N}-methyl-~{N}-(2-sulfanylethyl)benzamide |
| Formula: | C11 H13 N O2 S |
| Formal charge: | 0 |
| Formula weight: | 223.291 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 3.1.0.0 | 4-methanoyl-~{N}-methyl-~{N}-(2-sulfanylethyl)benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C11H13NO2S/c1-12(6-7-15)11(14)10-4-2-9(8-13)3-5-10/h2-5,8,15H,6-7H2,1H3 |
| InChIKey | InChI | 1.06 | QWNZTSSYNZIANR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(CCS)C(=O)c1ccc(C=O)cc1 |
| SMILES | CACTVS | 3.385 | CN(CCS)C(=O)c1ccc(C=O)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CN(CCS)C(=O)c1ccc(cc1)C=O |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CN(CCS)C(=O)c1ccc(cc1)C=O |
