9BE
Summary
| Name: | N-benzylthioformamide |
| Formula: | C8 H9 N S |
| Formal charge: | 0 |
| Formula weight: | 151.229 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-benzylthioformamide |
| OpenEye OEToolkits | 1.7.6 | N-(phenylmethyl)methanethioamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | S=CNCc1ccccc1 |
| InChI | InChI | 1.03 | InChI=1S/C8H9NS/c10-7-9-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,9,10) |
| InChIKey | InChI | 1.03 | QAADZYUXQLUXFX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | S=CNCc1ccccc1 |
| SMILES | CACTVS | 3.385 | S=CNCc1ccccc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)CNC=S |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)CNC=S |
