RUV
Summary
| Name: | 4-(acetylamino)-N-(4H-1,2,4-triazol-4-yl)benzamide |
| Formula: | C11 H11 N5 O2 |
| Formal charge: | 0 |
| Formula weight: | 245.237 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-(acetylamino)-N-(4H-1,2,4-triazol-4-yl)benzamide |
| OpenEye OEToolkits | 2.0.6 | 4-acetamido-~{N}-(1,2,4-triazol-4-yl)benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N(C(C)=O)c1ccc(cc1)C(=O)Nn2cnnc2 |
| InChI | InChI | 1.03 | InChI=1S/C11H11N5O2/c1-8(17)14-10-4-2-9(3-5-10)11(18)15-16-6-12-13-7-16/h2-7H,1H3,(H,14,17)(H,15,18) |
| InChIKey | InChI | 1.03 | AGTLIJXMGDFIBI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1ccc(cc1)C(=O)Nn2cnnc2 |
| SMILES | CACTVS | 3.385 | CC(=O)Nc1ccc(cc1)C(=O)Nn2cnnc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(=O)Nc1ccc(cc1)C(=O)Nn2cnnc2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC(=O)Nc1ccc(cc1)C(=O)Nn2cnnc2 |
