P95
Summary
| Name: | ~{N}-[3-(pyrimidin-2-ylcarbamoyl)thiophen-2-yl]-[1,3]thiazolo[4,5-c]pyridine-2-carboxamide |
| Formula: | C16 H10 N6 O2 S2 |
| Formal charge: | 0 |
| Formula weight: | 382.42 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | ~{N}-[3-(pyrimidin-2-ylcarbamoyl)thiophen-2-yl]-[1,3]thiazolo[4,5-c]pyridine-2-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H10N6O2S2/c23-12(22-16-18-4-1-5-19-16)9-3-7-25-14(9)21-13(24)15-20-10-8-17-6-2-11(10)26-15/h1-8H,(H,21,24)(H,18,19,22,23) |
| InChIKey | InChI | 1.03 | AJCHWWGZVVPQDY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C(Nc1sccc1C(=O)Nc2ncccn2)c3sc4ccncc4n3 |
| SMILES | CACTVS | 3.385 | O=C(Nc1sccc1C(=O)Nc2ncccn2)c3sc4ccncc4n3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cnc(nc1)NC(=O)c2ccsc2NC(=O)c3nc4cnccc4s3 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cnc(nc1)NC(=O)c2ccsc2NC(=O)c3nc4cnccc4s3 |
