DEW
Summary
| Name: | 2-azanyl-1-(6,7-dihydro-4~{H}-thieno[3,2-c]pyridin-5-yl)ethanone |
| Formula: | C9 H12 N2 O S |
| Formal charge: | 0 |
| Formula weight: | 196.269 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 2-azanyl-1-(6,7-dihydro-4~{H}-thieno[3,2-c]pyridin-5-yl)ethanone |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C9H12N2OS/c10-5-9(12)11-3-1-8-7(6-11)2-4-13-8/h2,4H,1,3,5-6,10H2 |
| InChIKey | InChI | 1.03 | NRRHFNCSXNXKHA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCC(=O)N1CCc2sccc2C1 |
| SMILES | CACTVS | 3.385 | NCC(=O)N1CCc2sccc2C1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1csc2c1CN(CC2)C(=O)CN |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1csc2c1CN(CC2)C(=O)CN |
