6UF
Summary
| Name: | ~{N}-(pyridin-2-ylmethyl)-2-(2-thiophen-2-ylindol-1-yl)ethanamide |
| Formula: | C20 H17 N3 O S |
| Formal charge: | 0 |
| Formula weight: | 347.433 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | ~{N}-(pyridin-2-ylmethyl)-2-(2-thiophen-2-ylindol-1-yl)ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C20H17N3OS/c24-20(22-13-16-7-3-4-10-21-16)14-23-17-8-2-1-6-15(17)12-18(23)19-9-5-11-25-19/h1-12H,13-14H2,(H,22,24) |
| InChIKey | InChI | 1.03 | HTRIQCMSXMSDKF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C(Cn1c2ccccc2cc1c3sccc3)NCc4ccccn4 |
| SMILES | CACTVS | 3.385 | O=C(Cn1c2ccccc2cc1c3sccc3)NCc4ccccn4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | c1ccc2c(c1)cc(n2CC(=O)NCc3ccccn3)c4cccs4 |
| SMILES | OpenEye OEToolkits | 2.0.5 | c1ccc2c(c1)cc(n2CC(=O)NCc3ccccn3)c4cccs4 |
