SH9
Summary
| Name: | 4-ethoxy-1-benzothiophene-2-carboximidamide |
| Formula: | C11 H12 N2 O S |
| Formal charge: | 0 |
| Formula weight: | 220.291 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-ethoxy-1-benzothiophene-2-carboximidamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C11H12N2OS/c1-2-14-8-4-3-5-9-7(8)6-10(15-9)11(12)13/h3-6H,2H2,1H3,(H3,12,13) |
| InChIKey | InChI | 1.06 | LOIXMYZGPMLLIW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCOc1cccc2sc(cc12)C(N)=N |
| SMILES | CACTVS | 3.385 | CCOc1cccc2sc(cc12)C(N)=N |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | [H]/N=C(\c1cc2c(cccc2s1)OCC)/N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCOc1cccc2c1cc(s2)C(=N)N |
