A1L8O
Summary
| Name: | 2-[5-(4-methylthiophen-3-yl)-1,2,4-oxadiazol-3-yl]-~{N}-[(1~{S})-1-phenylethyl]ethanamide |
| Formula: | C17 H17 N3 O2 S |
| Formal charge: | 0 |
| Formula weight: | 327.401 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-[5-(4-methylthiophen-3-yl)-1,2,4-oxadiazol-3-yl]-~{N}-[(1~{S})-1-phenylethyl]ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C17H17N3O2S/c1-11-9-23-10-14(11)17-19-15(20-22-17)8-16(21)18-12(2)13-6-4-3-5-7-13/h3-7,9-10,12H,8H2,1-2H3,(H,18,21)/t12-/m0/s1 |
| InChIKey | InChI | 1.06 | GKIJGQUFZLYJHC-LBPRGKRZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@H](NC(=O)Cc1noc(n1)c2cscc2C)c3ccccc3 |
| SMILES | CACTVS | 3.385 | C[CH](NC(=O)Cc1noc(n1)c2cscc2C)c3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cscc1c2nc(no2)CC(=O)N[C@@H](C)c3ccccc3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cscc1c2nc(no2)CC(=O)NC(C)c3ccccc3 |
