N7C
Summary
| Name: | ~{N}-(1-methylbenzimidazol-4-yl)prop-2-enamide |
| Formula: | C11 H11 N3 O |
| Formal charge: | 0 |
| Formula weight: | 201.225 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-(1-methylbenzimidazol-4-yl)prop-2-enamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C11H11N3O/c1-3-10(15)13-8-5-4-6-9-11(8)12-7-14(9)2/h3-7H,1H2,2H3,(H,13,15) |
| InChIKey | InChI | 1.06 | SJPYQEXWGCASRI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1cnc2c(NC(=O)C=C)cccc12 |
| SMILES | CACTVS | 3.385 | Cn1cnc2c(NC(=O)C=C)cccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cn1cnc2c1cccc2NC(=O)C=C |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cn1cnc2c1cccc2NC(=O)C=C |
