A1EPN
Summary
| Name: | 3-(phenylmethyl)imidazole-4-carboxamide |
| 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 | 3-(phenylmethyl)imidazole-4-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C11H11N3O/c12-11(15)10-6-13-8-14(10)7-9-4-2-1-3-5-9/h1-6,8H,7H2,(H2,12,15) |
| InChIKey | InChI | 1.06 | DFWACCVSZVPCAY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)c1cncn1Cc2ccccc2 |
| SMILES | CACTVS | 3.385 | NC(=O)c1cncn1Cc2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)Cn2cncc2C(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)Cn2cncc2C(=O)N |
