F4R
Summary
| Name: | N-dodecylmethanethioamide |
| Formula: | C13 H27 N S |
| Formal charge: | 0 |
| Formula weight: | 229.425 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-dodecylmethanethioamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H27NS/c1-2-3-4-5-6-7-8-9-10-11-12-14-13-15/h13H,2-12H2,1H3,(H,14,15) |
| InChIKey | InChI | 1.03 | BDXCOJKIHNDCOM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCCCCCCCNC=S |
| SMILES | CACTVS | 3.385 | CCCCCCCCCCCCNC=S |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCCCCNC=S |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCCCCNC=S |
