IAZ
Summary
| Name: | ~{N}-(furan-2-ylmethyl)-6-phenoxy-1~{H}-benzimidazol-2-amine |
| Formula: | C18 H15 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 305.331 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-(furan-2-ylmethyl)-6-phenoxy-1~{H}-benzimidazol-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C18H15N3O2/c1-2-5-13(6-3-1)23-14-8-9-16-17(11-14)21-18(20-16)19-12-15-7-4-10-22-15/h1-11H,12H2,(H2,19,20,21) |
| InChIKey | InChI | 1.06 | KHBMCLOQYWKNDZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C(Nc1[nH]c2cc(Oc3ccccc3)ccc2n1)c4occc4 |
| SMILES | CACTVS | 3.385 | C(Nc1[nH]c2cc(Oc3ccccc3)ccc2n1)c4occc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)Oc2ccc3c(c2)[nH]c(n3)NCc4ccco4 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)Oc2ccc3c(c2)[nH]c(n3)NCc4ccco4 |
