Y0S
Summary
| Name: | N-[(3-methylthiophen-2-yl)methyl]benzamide |
| Formula: | C13 H13 N O S |
| Formal charge: | 0 |
| Formula weight: | 231.313 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-[(3-methylthiophen-2-yl)methyl]benzamide |
| OpenEye OEToolkits | 2.0.7 | ~{N}-[(3-methylthiophen-2-yl)methyl]benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Cc1ccsc1CNC(=O)c1ccccc1 |
| InChI | InChI | 1.06 | InChI=1S/C13H13NOS/c1-10-7-8-16-12(10)9-14-13(15)11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,14,15) |
| InChIKey | InChI | 1.06 | WNIZEKJOPGQRGN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccsc1CNC(=O)c2ccccc2 |
| SMILES | CACTVS | 3.385 | Cc1ccsc1CNC(=O)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccsc1CNC(=O)c2ccccc2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccsc1CNC(=O)c2ccccc2 |
