WZD
Summary
| Name: | N-[(furan-2-yl)methyl]-1H-benzimidazol-2-amine |
| Formula: | C12 H11 N3 O |
| Formal charge: | 0 |
| Formula weight: | 213.235 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-[(furan-2-yl)methyl]-1H-benzimidazol-2-amine |
| OpenEye OEToolkits | 2.0.7 | ~{N}-(furan-2-ylmethyl)-1~{H}-benzimidazol-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1cccc2c1nc(n2)NCc3ccco3 |
| InChI | InChI | 1.03 | InChI=1S/C12H11N3O/c1-2-6-11-10(5-1)14-12(15-11)13-8-9-4-3-7-16-9/h1-7H,8H2,(H2,13,14,15) |
| InChIKey | InChI | 1.03 | VVXTVMPZTWGDLF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C(Nc1[nH]c2ccccc2n1)c3occc3 |
| SMILES | CACTVS | 3.385 | C(Nc1[nH]c2ccccc2n1)c3occc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)[nH]c(n2)NCc3ccco3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)[nH]c(n2)NCc3ccco3 |
