A1CO8
Summary
| Name: | 2-(1H-1,3-benzimidazol-2-yl)acetamide |
| Formula: | C9 H9 N3 O |
| Formal charge: | 0 |
| Formula weight: | 175.187 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 2-(1H-1,3-benzimidazol-2-yl)acetamide |
| OpenEye OEToolkits | 3.1.0.0 | 2-(1~{H}-benzimidazol-2-yl)ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | NC(=O)Cc1nc2ccccc2[NH]1 |
| InChI | InChI | 1.06 | InChI=1S/C9H9N3O/c10-8(13)5-9-11-6-3-1-2-4-7(6)12-9/h1-4H,5H2,(H2,10,13)(H,11,12) |
| InChIKey | InChI | 1.06 | STRDCKXOEFPOCT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)Cc1[nH]c2ccccc2n1 |
| SMILES | CACTVS | 3.385 | NC(=O)Cc1[nH]c2ccccc2n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1ccc2c(c1)[nH]c(n2)CC(=O)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1ccc2c(c1)[nH]c(n2)CC(=O)N |
