BS0
Summary
| Name: | 6-[2-(phenoxymethyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one |
| Formula: | C19 H16 N2 O2 S |
| Formal charge: | 0 |
| Formula weight: | 336.408 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 6-[2-(phenoxymethyl)-1,3-thiazol-4-yl]-3,4-dihydro-1~{H}-quinolin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C19H16N2O2S/c22-18-9-7-13-10-14(6-8-16(13)20-18)17-12-24-19(21-17)11-23-15-4-2-1-3-5-15/h1-6,8,10,12H,7,9,11H2,(H,20,22) |
| InChIKey | InChI | 1.03 | QXHYTMRDSBLWLI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1CCc2cc(ccc2N1)c3csc(COc4ccccc4)n3 |
| SMILES | CACTVS | 3.385 | O=C1CCc2cc(ccc2N1)c3csc(COc4ccccc4)n3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)OCc2nc(cs2)c3ccc4c(c3)CCC(=O)N4 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)OCc2nc(cs2)c3ccc4c(c3)CCC(=O)N4 |
