5UB
Summary
| Name: | 8-(1,3-thiazol-4-yl)-3~{H}-pyrido[3,4-d]pyrimidin-4-one |
| Formula: | C10 H6 N4 O S |
| Formal charge: | 0 |
| Formula weight: | 230.246 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.4 | 8-(1,3-thiazol-4-yl)-3~{H}-pyrido[3,4-d]pyrimidin-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H6N4OS/c15-10-6-1-2-11-9(7-3-16-5-14-7)8(6)12-4-13-10/h1-5H,(H,12,13,15) |
| InChIKey | InChI | 1.03 | OBJLYJZXQQXIFV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1NC=Nc2c1ccnc2c3cscn3 |
| SMILES | CACTVS | 3.385 | O=C1NC=Nc2c1ccnc2c3cscn3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | c1cnc(c2c1C(=O)NC=N2)c3cscn3 |
| SMILES | OpenEye OEToolkits | 2.0.4 | c1cnc(c2c1C(=O)NC=N2)c3cscn3 |
